SCHEMBL916379

SCHEMBL916379

N#Cc1cc(C#N)cc(CBr)c1

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.41
ALB P02768 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LOXL2 Q9Y4K0 2/20 0.36
CYP2A6 P11509 1/20 0.36
GSK3B P49841 2/20 0.34
VCAM1 P19320 2/20 0.33
FFAR1 O14842 1/20 0.33
TSHR P16473 2/20 0.32
TRPA1 O75762 1/20 0.32
ALDH1A1 P00352 1/20 0.32
MEP1A Q16819 1/20 0.32
MEP1B Q16820 1/20 0.32
GLA P06280 1/20 0.32
MAOB P27338 1/20 0.31
HTT P42858 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
SCHEMBL14689467 0.95 TTR (0.41) TTRALBMEN1KMT2ALOXL2
SCHEMBL307886 0.86 TTR (0.40) TTRALBMEN1KMT2ALOXL2
SCHEMBL502113 0.84 CYP2A6 (0.38) TTRALBMEN1KMT2ALOXL2
SCHEMBL319504 0.84 GRM5 (0.35) TTRALBMEN1KMT2A
SCHEMBL29413304 0.84 ADRA1D (0.40) TTRALBMEN1KMT2AVCAM1
SCHEMBL24022774 0.84 TTR (0.39) TTRALBMEN1KMT2ALOXL2
SCHEMBL408730 0.84 ADRA1D (0.40) TTRALBMEN1KMT2AVCAM1
SCHEMBL29413211 0.84 GRM5 (0.35) TTRALBMEN1KMT2A
SCHEMBL32675278 0.81 TTR (0.36) TTRALBMEN1KMT2ALOXL2
SCHEMBL6683961 0.80 ALDH1A1 (0.41) TSHRALDH1A1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12590062-B2 PD-1/PD-L1 inhibitors GILEAD SCIENCES, INC. (US) 2026-03-31 US disclosed
EP-4612154-A1 REGULATORS OF PORPHYRIN AND INTERMEDIATES Madera Therapeutics, LLC (US) 2025-09-10 EP disclosed
WO-2024097436-A1 REGULATORS OF PORPHYRIN AND INTERMEDIATES Madera Therapeutics, LLC (US) 2024-05-10 WO disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
EP-4026835-A2 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2022-07-13 EP disclosed
EP-3612525-B1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES INC (US) 2021-10-27 EP disclosed
EP-3612525-B1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES INC (US) 2021-10-27 EP disclosed
US-20210323922-A1 PD-1/PD-L1 INHIBITORS GILEAD SCIENCES, INC. (US) 2021-10-21 US disclosed
EP-3612525-A1 PD-1/PD-L1 INHIBITORS Gilead Sciences, Inc. (US) 2020-02-26 EP disclosed
CN-110799509-A PD-1/PD-L1 inhibitors 吉利德科学公司 2020-02-14 CN disclosed
EP-1742912-A1 NOVEL ANDROGENS N.V. Organon (NL) 2007-01-17 EP disclosed
US-7141585-B2 Pyrazole derivatives AGOURON PHARMACEUTICALS, INC. (US) 2006-11-28 US disclosed
EP-1299361-B1 PYRAZOLE DERIVATIVES PFIZER LTD (GB) 2006-07-19 EP disclosed
WO-2005102998-A1 NOVEL ANDROGENS N.V. ORGANON (NL) 2005-11-03 WO disclosed
US-20040209862-A1 Pyrazole derivatives PFIZER, INC. 2004-10-21 US disclosed
US-6750230-B2 use treating Human Immunodeficiency Virus (HIV) , or genetically related retroviral, infection or a resulting acquired immunodeficiency syndrome (AIDS); 2-[4-(3,5-dichlorobenzyl)-3,5-diethyl-1H-pyrazol-1-yl]ethanol for example; reverse transcriptase inhibitors PFIZER, INC. 2004-06-15 US disclosed
EP-1299361-A1 PYRAZOLE DERIVATIVES Pfizer Limited (GB) 2003-04-09 EP disclosed
WO-2002004424-A9 PYRAZOLE DERIVATIVES PFIZER LTD (GB) 2002-12-12 WO disclosed
US-20020032184-A1 Pyrazole derivatives PFIZER INC. 2002-03-14 US disclosed
WO-2002004424-A1 PYRAZOLE DERIVATIVES PFIZER LIMITED (GB) 2002-01-17 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 (4 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-20210323922-A1 PD-1/PD-L1 INHIBITORS CD274, PDCD1, PDCD1LG2 TTR 3821/4885ALB 2690/4885MEN1 1022/4885
US-20020032184-A1 Pyrazole derivatives POLRMT, TPMT, CYP3A43 TTR 371/4885ALB 3329/4885MEN1 4199/4885
US-12590062-B2 PD-1/PD-L1 inhibitors CD274, PDCD1LG2, PDCD1 TTR 2913/4885ALB 3215/4885MEN1 3035/4885
US-20040209862-A1 Pyrazole derivatives POLRMT, TPMT, CYP3A43 TTR 371/4885ALB 3329/4885MEN1 4199/4885

“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.