SCHEMBL719667

SCHEMBL719667

O=Cc1cc2cccc(Br)c2nc1Cl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
KDR P35968 10/20 0.43
CYP1A2 P05177 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
CYP2C19 P33261 1/20 0.42
BACE1 P56817 1/20 0.40
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
MPI P34949 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
NPC1 O15118 1/20 0.36
GAA P10253 1/20 0.36
RAB9A P51151 1/20 0.36
CYP2A6 P11509 1/20 0.36

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
SCHEMBL29683769 0.83 ALDH1A1 (0.46) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL5116 0.83 ALDH1A1 (0.46) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL458716 0.80 KDR (0.54) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL19331488 0.80 ALDH1A1 (0.44) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL1881135 0.78 ALDH1A1 (0.45) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL5043535 0.76 ALDH1A1 (0.44) ALDH1A1KDRCYP1A2CYP3A4CYP2D6
SCHEMBL4181276 0.76 PDE3B (0.46) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL21435080 0.75 MAPT (0.50) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL29951253 0.75 PARP1 (0.48) ALDH1A1KDRMAPTKDM4EMEN1
SCHEMBL21434311 0.74 ALDH1A1 (0.45) ALDH1A1KDRCYP1A2CYP3A4CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200048265-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2020-02-13 US disclosed
US-10442799-B1 Heterocyclic compounds and uses thereof RUAN FUQIANG (US) 2019-10-15 US disclosed
US-20190308963-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF RUAN FUQIANG (US) 2019-10-10 US disclosed
US-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2018-04-19 US disclosed
US-9873701-B2 Heterocyclic compounds and their uses AMGEN INC. (US) 2018-01-23 US disclosed
EP-3045458-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2016-07-20 EP disclosed
EP-3045458-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen, Inc (US) 2016-07-20 EP disclosed
EP-2403847-B1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB BIOPHARMA SPRL (BE) 2016-03-02 EP disclosed
EP-2137186-B1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC (US) 2016-01-27 EP disclosed
EP-2137186-B1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC (US) 2016-01-27 EP disclosed
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors UCB PHARMA, S.A. (BE) 2012-03-01 US disclosed
EP-2403847-A1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB Pharma, S.A. (BE) 2012-01-11 EP disclosed
WO-2010100405-A1 TRIAZINE DERIVATIVES AS KINASE INHIBITORS UCB PHARMA S.A. (BE) 2010-09-10 WO disclosed
CN-101715453-A Heterogeneous ring compound and application thereof AMGEN INC 2010-05-26 CN disclosed
EP-2137186-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES Amgen Inc. (US) 2009-12-30 EP disclosed
US-20090137581-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-05-28 US disclosed
US-20090137581-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-05-28 US disclosed
US-20090137581-A1 Heterocyclic compounds and their uses AMGEN INC. 2009-05-28 US disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 WO disclosed
WO-2008118468-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES AMGEN INC. (US) 2008-10-02 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 (6 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-20190308963-A1 HETEROCYCLIC COMPOUNDS AND USES THEREOF BRD4, BICRA, BET1 ALDH1A1 4202/4885KDR 2131/4885CYP1A2 3288/4885
US-20200048265-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 ALDH1A1 3905/4885KDR 1583/4885CYP1A2 2390/4885
US-10442799-B1 Heterocyclic compounds and uses thereof BRD4, BICRA, BET1 ALDH1A1 4202/4885KDR 2131/4885CYP1A2 3288/4885
US-20090137581-A1 Heterocyclic compounds and their uses MCL1, BCL9, MALT1 ALDH1A1 3905/4885KDR 1583/4885CYP1A2 2390/4885
US-20120053167-A1 Triazine Derivatives as Kinase Inhibitors MAP3K15, PI4KA, MAP3K20 ALDH1A1 3504/4885KDR 437/4885CYP1A2 2609/4885
US-20180105532-A1 HETEROCYCLIC COMPOUNDS AND THEIR USES MCL1, BCL9, MALT1 ALDH1A1 3905/4885KDR 1583/4885CYP1A2 2390/4885

“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.