SCHEMBL378129

SCHEMBL378129

CC1(C)CCCCN1C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.34
NFKB1 P19838 1/20 0.34
CYP2C19 P33261 1/20 0.34
ALDH1A1 P00352 2/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM5A P29375 1/20 0.31
KDM4C Q9H3R0 1/20 0.31
DPP4 P27487 1/20 0.30
CNR2 P34972 2/20 0.30
SPR P35270 1/20 0.30

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
SCHEMBL12499298 0.98 ALDH1A1 (0.35) TSHRNFKB1CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL3469463 0.93 TSHR (0.35) TSHRNFKB1CYP2C19KDM5AKDM4C
Hydrochloric Acid SCHEMBL29089994 0.91 TSHR (0.34) TSHRNFKB1CYP2C19KDM5AKDM4C
SCHEMBL21296526 0.84
SCHEMBL4020424 0.82 ALDH1A1 (0.37) TSHRNFKB1CYP2C19ALDH1A1KDM5A
SCHEMBL18711702 0.80 TSHR (0.35) TSHRNFKB1CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL15319783 0.80 TSHR (0.39) TSHRNFKB1CYP2C19ALDH1A1KDM5A
SCHEMBL10590189 0.78 TSHR (0.34) TSHRNFKB1CYP2C19ALDH1A1KDM5A
SCHEMBL20707613 0.78 ALDH1A1 (0.34) TSHRNFKB1CYP2C19ALDH1A1SMN1; SMN2
SCHEMBL9059659 0.78 F2 (0.39)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108698992-B 2-cyanoisoindoline derivatives for the treatment of cancer 特殊治疗有限公司 2022-04-19 CN claimed
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer MISSION THERAPEUTICS LIMITED (GB) 2020-06-16 US claimed
US-20180092924-A1 NOVEL QUINAZOLINONES AS BROMODOMAIN INHIBITORS RVX THERAPEUTICS INC. (CA) 2018-04-05 US claimed
EP-3027604-A2 NOVEL QUINAZOLINONES AS BROMODOMAIN INHIBITORS Zenith Epigenetics Corp. (CA) 2016-06-08 EP claimed
EP-2874632-A2 NOVEL TRIAZINE COMPOUNDS Sphaera Pharma Pte. Ltd (SG) 2015-05-27 EP claimed
US-8957081-B2 Compounds and compositions as protein kinase inhibitors IRM LLC (BM) 2015-02-17 US claimed
WO-2014016849-A9 NOVEL TRIAZINE COMPOUNDS SPHAERA PHARMA PTE. LTD. (SG) 2014-03-13 WO claimed
WO-2014016849-A2 NOVEL TRIAZINE COMPOUNDS SPHAERA PHARMA PVT. LTD. (SG) 2014-01-30 WO claimed
WO-2013175281-A1 USE OF SUBSTITUTED 2-PHENYL-3H-QUINAZOLIN-4-ONES AND ANALOGS FOR INHIBITING BROMODOMAIN AND EXTRA TERMINAL DOMAIN (BET) PROTEINS RVX THERAPEUTICS INC. (CA) 2013-11-28 WO claimed
CN-103214376-A Substituted 4-aminocyclohexane derivatives GRUENENTHAL GMBH 2013-07-24 CN claimed
CN-103183630-A Substituted 4-aminocyclohexane derivatives GRUENENTHAL GMBH 2013-07-03 CN claimed
US-20130005748-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS IRM LLC (BM) 2013-01-03 US claimed
CN-102046595-A Substituted 4-aminocyclohexane derivatives GRUENENTHAL GMBH 2011-05-04 CN claimed
JP-2007523072-A 2007-08-16 JP claimed
EP-1713781-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2006-10-25 EP claimed
WO-2005075439-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-08-18 WO claimed
US-20260138951-A1 TREATING PKU WITH SPIRO-SUBSTITUTED AND OTHER PIPERIDINE INHIBITORS OF SLC6A19 FUNCTION JNANA THERAPEUTICS INC (US) 2026-05-21 US disclosed
US-20260098032-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION PMV PHARMACEUTICALS INC (US) 2026-04-09 US disclosed
WO-2006021656-A2 AMINOPIPERIDINE DERIVATIVES, PREPARATION THEREOF AND USE THEREOF AS MELANOCORTIN RECEPTOR AGONISTS SANOFI-AVENTIS (FR) 2006-03-02 WO disclosed
WO-2005075439-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-08-18 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 (5 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-20260138951-A1 TREATING PKU WITH SPIRO-SUBSTITUTED AND OTHER PIPERIDINE INHIBITORS OF SLC6A19 FUNCTION SLC6A19, SLC6A9, SLC2A9 TSHR 1620/4885NFKB1 4521/4885CYP2C19 177/4885
US-10683269-B2 2-cyanoisoindoline derivatives for treating cancer USP7, USP47, USP2 TSHR 4510/4885NFKB1 1121/4885CYP2C19 2893/4885
US-20180092924-A1 NOVEL QUINAZOLINONES AS BROMODOMAIN INHIBITORS BRD4, BRD3, BRDT TSHR 3605/4885NFKB1 1010/4885CYP2C19 4755/4885
US-20260098032-A1 METHODS AND COMPOUNDS FOR RESTORING MUTANT p53 FUNCTION TP53, TP53BP1, MDM2 TSHR 2535/4885NFKB1 2533/4885CYP2C19 2370/4885
US-20130005748-A1 COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS ZAP70, IGF1R, PTK2 TSHR 1191/4885NFKB1 1275/4885CYP2C19 4700/4885

“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.