SCHEMBL3661207

SCHEMBL3661207

CC(C)(C(=O)O)N1CCCC1

nearest known ligand 0.42

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.42
TSHR P16473 2/20 0.38
CYP2B6 P20813 1/20 0.37
CYP2C19 P33261 2/20 0.36
CYP2D6 P10635 1/20 0.36
HIF1A Q16665 1/20 0.36
HSD11B1 P28845 1/20 0.34
HSD11B2 P80365 1/20 0.34
CHRM3 P20309 2/20 0.33
SIGMAR1 Q99720 2/20 0.32
LMNA P02545 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
KMT2A Q03164 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8827280 0.97 ALDH1A1 (0.45) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL10277739 0.97 ALDH1A1 (0.41) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL28286231 0.95 ALDH1A1 (0.44) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
SCHEMBL25076094 0.94 ALDH1A1 (0.38) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
Hydrochloric Acid SCHEMBL20580252 0.92 ALDH1A1 (0.36) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
SCHEMBL7159906 0.88
SCHEMBL14549470 0.88 ALDH1A1 (0.42) ALDH1A1TSHRCYP2C19CYP2D6HIF1A
SCHEMBL6879309 0.79 ALDH1A1 (0.44) ALDH1A1TSHRCYP2B6CYP2C19CYP2D6
SCHEMBL14615948 0.79 CYP1A2 (0.42) ALDH1A1TSHRSIGMAR1LMNAMEN1
SCHEMBL22045060 0.78 HSD11B1 (0.34) ALDH1A1CYP2B6CYP2C19HSD11B1HSD11B2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 35 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260091081-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE HANGZHOU DAC BIOTECH CO., LTD (CN) 2026-04-02 US disclosed
US-12576124-B2 Formulation of a conjugate of a tubulysin analog to a cell-binding molecule HANGZHOU DAC BIOTECH CO., LTD (CN) 2026-03-17 US disclosed
US-20240368150-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER HOFFMANN-LA ROCHE INC. (US) 2024-11-07 US disclosed
US-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents HANGZHOU DAC BIOTECH CO., LTD. (CN) 2024-01-16 US disclosed
US-20220249594-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE HANGZHOU DAC BIOTECH CO., LTD (CN) 2022-08-11 US disclosed
EP-3986476-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE Hangzhou Dac Biotech Co., Ltd. (CN) 2022-04-27 EP disclosed
CN-114040781-A Formulation of conjugate of TUBULYSIN derivative and cell binding molecule 杭州多禧生物科技有限公司 2022-02-11 CN disclosed
EP-3862023-A1 CONJUGATES OF CELL-BINDING MOLECULES WITH CYTOTOXIC AGENTS Hangzhou DAC Biotech Co, Ltd (CN) 2021-08-11 EP disclosed
EP-3862023-A1 CONJUGATES OF CELL-BINDING MOLECULES WITH CYTOTOXIC AGENTS Hangzhou DAC Biotech Co, Ltd (CN) 2021-08-11 EP disclosed
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS HANGZHOU DAC BIOTECH CO., LTD. (CN) 2020-06-04 US disclosed
EP-2788349-A1 KINASE INHIBITORS Chiesi Farmaceutici S.p.A. (IT) 2014-10-15 EP disclosed
CN-104039787-A Kinase inhibitors CHIESI FARMA SPA 2014-09-10 CN disclosed
CN-102483572-B Photopolymerizable composition, color filter, method for producing same, solid-state image pickup element, liquid crystal display device, lithographic printing original plate, and novel compound FUJI PHOTO FILM CO LTD 2014-04-09 CN disclosed
WO-2013083604-A1 KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-06-13 WO disclosed
US-20130150343-A1 KINASE INHIBITORS CHIESI FARMACEUTICI S.P.A. (IT) 2013-06-13 US disclosed
CN-102483572-A Photopolymerizable composition, color filter, method for producing same, solid-state image pickup element, liquid crystal display device, lithographic printing original plate, and novel compound FUJIFILM CORP 2012-05-30 CN disclosed
CN-101952289-A Fused pentacyclic derivatives for use in the treatment of flavivirus infections GENELABS TECH INC 2011-01-19 CN disclosed
EP-2231668-A1 CONDENSED PENTACYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF FLAVIVIRIDAE INFECTIONS GlaxoSmithKline LLC (US) 2010-09-29 EP disclosed
US-20090197856-A1 ANTIVIRAL COMPOUNDS GENELABS TECHNOLOGIES, INC. 2009-08-06 US disclosed
WO-2009086139-A1 CONDENSED PENTACYCLIC DERIVATIVES FOR USE IN THE TREATMENT OF FLAVIVIRIDAE INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2009-07-09 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (8 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-11873281-B2 Conjugates of cell binding molecules with cytotoxic agents CD4, CD2, CD47 ALDH1A1 3075/4885TSHR 107/4885CYP2B6 4620/4885
US-20090197856-A1 ANTIVIRAL COMPOUNDS ZC3HAV1, EIF2AK2, MAVS ALDH1A1 2216/4885TSHR 4724/4885CYP2B6 633/4885
US-20200172480-A1 CONJUGATES OF CELL BINDING MOLECULES WITH CYTOTOXIC AGENTS CD4, CD2, CD47 ALDH1A1 3075/4885TSHR 107/4885CYP2B6 4620/4885
US-12576124-B2 Formulation of a conjugate of a tubulysin analog to a cell-binding molecule CD4, TAP1, MCTS1 ALDH1A1 4592/4885TSHR 936/4885CYP2B6 4864/4885
US-20240368150-A1 BICYCLIC TETRAHYDROAZEPINE DERIVATIVES FOR THE TREATMENT OF CANCER BICRA, BRD4, CNR1 ALDH1A1 1572/4885TSHR 756/4885CYP2B6 254/4885
US-20260091081-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE CD4, MALT1, LY6K ALDH1A1 4331/4885TSHR 381/4885CYP2B6 3906/4885
US-20220249594-A1 A FORMULATION OF A CONJUGATE OF A TUBULYSIN ANALOG TO A CELL-BINDING MOLECULE CD4, TEKT1, NTSR1 ALDH1A1 4744/4885TSHR 158/4885CYP2B6 4531/4885
US-20130150343-A1 KINASE INHIBITORS MAPK1, MAP3K1, MAPK6 ALDH1A1 1736/4885TSHR 1675/4885CYP2B6 649/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.