SCHEMBL1680141

SCHEMBL1680141

Cc1cc(C(=O)O)n(-c2cccc(C#N)c2)n1

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 1/20 0.53
NOTUM Q6P988 2/20 0.52
TSHR P16473 4/20 0.46
ALDH1A1 P00352 2/20 0.46
GAA P10253 1/20 0.46
KMT2A Q03164 2/20 0.45
GRN P28799 1/20 0.45
SORT1 Q99523 1/20 0.45
MDM2 Q00987 1/20 0.44
F11 P03951 1/20 0.44
ADORA2A P29274 1/20 0.43
TP53 P04637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
HSD17B10 Q99714 1/20 0.43
LMNA P02545 1/20 0.42

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
Hydrochloric Acid SCHEMBL3830146 0.99 F10 (0.52) F10NOTUMTSHRALDH1A1GAA
SCHEMBL23429155 0.89 F10 (0.53) F10NOTUMTSHRALDH1A1KMT2A
SCHEMBL3830143 0.88 F10 (0.52) F10NOTUMTSHRALDH1A1KMT2A
SCHEMBL15428605 0.88 F10 (0.55) F10NOTUMTSHRALDH1A1KMT2A
SCHEMBL3834635 0.86 F10 (0.53) F10NOTUMTSHRALDH1A1KMT2A
SCHEMBL3225544 0.85 TSHR (0.46) TSHRALDH1A1GAAKMT2AGRN
SCHEMBL2926051 0.84 ALDH1A1 (0.68) F10NOTUMTSHRALDH1A1GAA
SCHEMBL3833007 0.84 KMT2A (0.51) F10ALDH1A1KMT2ALMNA
SCHEMBL31067538 0.84 KMT2A (0.51) F10ALDH1A1KMT2ALMNA
SCHEMBL15279101 0.83 NOTUM (0.55) F10NOTUMTSHRALDH1A1F11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4663636-A2 TRIFLUOROMETHYL SUBSTITUTED PYRAZOLES AS HUMAN PLASMA KALLIKREIN INHIBITORS BioCryst Pharmaceuticals, Inc. (US) 2025-12-17 EP disclosed
US-20250270171-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2025-08-28 US disclosed
US-20250257040-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2025-08-14 US disclosed
EP-4180424-B1 SUBSTITUTED PYRAZOLES AS HUMAN PLASMA KALLIKREIN INHIBITORS BIOCRYST PHARM INC (US) 2025-06-25 EP disclosed
US-12162838-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2024-12-10 US disclosed
US-12116346-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2024-10-15 US disclosed
CN-113307772-B Human plasma kallikrein inhibitors 拜奥克里斯特制药公司 2024-06-28 CN disclosed
US-20240150296-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-05-09 US disclosed
US-20240150295-A1 HUMAN PLASMA KALLIKREIN INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION 2024-05-09 US disclosed
US-11708332-B2 Human plasma kallikrein inhibitors BIOCRYST PHARMACEUTICALS, INC. (US) 2023-07-25 US disclosed
US-20040171649-A1 Novel substituted 1h-dihydropyrazoles, their preparation and use E. I. DU PONT DE NEMOURS AND COMPANY 2004-09-02 US disclosed
EP-1417175-A1 SUBSTITUTED DIHYDRO 3-HALO-1H-PYRAZOLE-5-CARBOXYLATES, THEIR PREPARATION AND USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-05-12 EP disclosed
EP-1417200-A2 SUBSTITUTED 1H-DIHYDROPYRAZOLES, THEIR PREPARATION AND USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2004-05-12 EP disclosed
US-6548512-B1 Pyrazole derivatives such as 1-(3-amidinophenyl)-3-methyl-2-((5-(2'-aminosulfonylphenyl-1-yl)pyrimidin-2 -yl)aminocarbonyl)pyrazole; treating thromboembolic disorders BRISTOL-MYERS SQUIBB PHARMA COMPANY 2003-04-15 US disclosed
WO-2003016283-A1 SUBSTITUTED DIHYDRO 3-HALO-1H-PYRAZOLE-5-CARBOXYLATES THEIR PREPARATION AND USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-02-27 WO disclosed
WO-2003016282-A2 SUBSTITUTED 1H-DIHYDROPYRAZOLES, THEIR PREPARATION AND USE E.I. DU PONT DE NEMOURS AND COMPANY (US) 2003-02-27 WO disclosed
CN-1246847-A Nitrogen containing heteroaromatics as factor Xa inhibitors DU PONT MERCK PHARMA (US) 2000-03-08 CN disclosed
US-6020357-A CARDIOVASCULAR DISORDERS; ANTCOAGULANTS DUPONT PHARMACEUTICALS COMPANY (US) 2000-02-01 US disclosed
EP-0946508-A1 NITROGEN CONTAINING HETEROAROMATICS AS FACTOR Xa INHIBITORS Du Pont Pharmaceuticals Company (US) 1999-10-06 EP disclosed
WO-1998028269-A1 NITROGEN CONTAINING HETEROAROMATICS AS FACTOR Xa INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1998-07-02 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 (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-20040171649-A1 Novel substituted 1h-dihydropyrazoles, their preparation and use CYP2D6, CYP1B1, CYP3A5 F10 1956/4885NOTUM 3199/4885TSHR 4019/4885
US-12116346-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885
US-20250270171-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885
US-20240150296-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885
US-11708332-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 F10 115/4885NOTUM 373/4885TSHR 3754/4885
US-20240150295-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885
US-20250257040-A1 HUMAN PLASMA KALLIKREIN INHIBITORS KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885
US-12162838-B2 Human plasma kallikrein inhibitors KLKB1, KLK5, KLK1 F10 112/4885NOTUM 352/4885TSHR 3844/4885

“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.