SCHEMBL11841

SCHEMBL11841

Cc1ccc(CN2CCC(O)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.57
ACHE P22303 2/20 0.54
BACE1 P56817 2/20 0.54
BCHE P06276 1/20 0.54
LMNA P02545 1/20 0.51
POLB P06746 1/20 0.51
GBA1 P04062 1/20 0.51
HRH1 P35367 1/20 0.51
LTA4H P09960 4/20 0.51
MEN1 O00255 1/20 0.50
CYP2D6 P10635 1/20 0.50
RAB9A P51151 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.49

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
SCHEMBL13479261 1.00 ALDH1A1 (0.57) ALDH1A1ACHEBACE1BCHELMNA
SCHEMBL10272308 1.00 ALDH1A1 (0.57) ALDH1A1ACHEBACE1BCHELMNA
SCHEMBL20160542 0.90 ALDH1A1 (0.71) ALDH1A1ACHEBACE1BCHELMNA
SCHEMBL16121539 0.90 ALDH1A1 (0.71) ALDH1A1ACHEBACE1BCHELMNA
SCHEMBL4700996 0.89 ALDH1A1 (0.60) ALDH1A1ACHEBACE1LMNAPOLB
SCHEMBL2920097 0.85 GBA1 (0.61) ALDH1A1LMNAPOLBGBA1HRH1
SCHEMBL27883989 0.84 ALDH1A1 (0.58) ALDH1A1ACHEBACE1BCHELTA4H
SCHEMBL1239292 0.83 ALDH1A1 (0.57) ALDH1A1ACHEBACE1BCHELTA4H
SCHEMBL3935867 0.83 ALDH1A1 (0.57) ALDH1A1LMNAGBA1LTA4HMEN1
SCHEMBL1239295 0.83 ALDH1A1 (0.57) ALDH1A1ACHEBACE1BCHELTA4H

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases ARRAY BIOPHARMA INC (US) 2022-02-15 US disclosed
EP-3333157-B1 VINYL COMPOUNDS AS FGFR AND VEGFR INHIBITORS HARBIN ZHENBAO PHARMACEUTICAL CO LTD (CN) 2020-12-23 EP disclosed
WO-2019113190-A1 BICYCLIC FUSED PYRIDINE COMPOUNDS AS INHIBITORS OF TAM KINASES ARRAY BIOPHARMA INC. (US) 2019-06-13 WO disclosed
EP-3333157-A1 VINYL COMPOUNDS AS FGFR AND VEGFR INHIBITORS Harbin Zhenbao Pharmaceutical Co., Ltd. (CN) 2018-06-13 EP disclosed
US-9834521-B2 Choline kinase inhibitors ARIAD PHARMACEUTICALS, INC. (US) 2017-12-05 US disclosed
EP-2440554-B1 PYRAZOLE OXADIAZOLE DERIVATIVES AS S1P1 AGONISTS MERCK SERONO SA (CH) 2016-10-05 EP disclosed
EP-2499146-B1 TRICYCLIC PYRAZOL AMINE DERIVATIVES MERCK SERONO SA (CH) 2016-09-21 EP disclosed
US-20160024024-A1 Novel Choline Kinase Inhibitors ARIAD PHARMACEUTICALS, INC. 2016-01-28 US disclosed
WO-2014151761-A1 NOVEL CHOLINE KINASE INHIBITORS ARIAD PHARMACEUTICALS, INC. (US) 2014-09-25 WO disclosed
WO-2011058149-A1 TRICYCLIC PYRAZOL AMINE DERIVATIVES MERCK SERONO S.A. (CH) 2011-05-19 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 (2 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-20160024024-A1 Novel Choline Kinase Inhibitors CHKA, CHKB, CEPT1 ALDH1A1 2140/4885ACHE 27/4885BACE1 679/4885
US-11247990-B1 Bicyclic fused pyridine compounds as inhibitors of TAM kinases MAP3K1, MAP3K3, MAP3K2 ALDH1A1 3807/4885ACHE 4351/4885BACE1 2722/4885

“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.