SCHEMBL474360

SCHEMBL474360

NC(=O)Cc1cncnc1

nearest known ligand 0.46

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.46
HCAR2 Q8TDS4 1/20 0.41
HTT P42858 1/20 0.38
NAPRT Q6XQN6 1/20 0.36
RECQL P46063 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2C9 P11712 1/20 0.36
VNN1 O95497 1/20 0.36
CYP11B2 P19099 1/20 0.35

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
SCHEMBL1227049 0.78 NAPRT (0.57) CA2HCAR2HTTNAPRTCYP3A4
SCHEMBL17983732 0.77 CAPN1 (0.46) HCAR2RECQLCYP1A2CYP3A4CYP2C9
SCHEMBL16887645 0.76 HCAR2 (0.41) HCAR2NAPRTCYP1A2CYP3A4CYP2C9
Hydrochloric Acid SCHEMBL1373539 0.76 NAPRT (0.55) CA2HCAR2HTTNAPRTCYP3A4
SCHEMBL2438139 0.76 TBXAS1 (0.40) HCAR2RECQLVNN1
SCHEMBL18071086 0.76 HCAR2 (0.37) HCAR2HTTNAPRTRECQLCYP1A2
SCHEMBL5178108 0.74 AKT1 (0.43)
SCHEMBL4536602 0.74 CA2 (0.42) CA2
Hydrochloric Acid SCHEMBL17610968 0.74 HTR3E (0.38) HCAR2
SCHEMBL794394 0.74 NAPRT (0.69) NAPRTRECQLCYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2411395-A1 FUROPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2012-02-01 EP claimed
EP-2411396-A2 THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2012-02-01 EP claimed
EP-2411393-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2012-02-01 EP claimed
WO-2011132017-A1 PYRIDO[3,4-D]PYRIMIDINYL ACETAMIDE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO claimed
WO-2010109334-A2 THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS, S.A. (CH) 2010-09-30 WO claimed
US-20250129091-A1 THIENOPYRROLOTRIAZINE COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC USE SANOFI (FR) 2025-04-24 US disclosed
US-20240336592-A1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 REDX PHARMA PLC (GB) 2024-10-10 US disclosed
WO-2024154979-A2 NOVEL HETEROCYCLIC COMPOUNDS 주식회사 이노보테라퓨틱스 2024-07-25 WO disclosed
US-20230416205-A1 COMPOUNDS, COMPOSITIONS, AND METHODS TENVIE THERAPEUTICS, INC. 2023-12-28 US disclosed
US-11737463-B2 Pyridine and pyrazine compounds BASF SE (DE) 2023-08-29 US disclosed
WO-2023134629-A1 NUCLEAR TRANSPORT REGULATOR AND USE THEREOF 上海海雁医药科技有限公司 2023-07-20 WO disclosed
WO-2023134629-A1 NUCLEAR TRANSPORT REGULATOR AND USE THEREOF 上海海雁医药科技有限公司 2023-07-20 WO disclosed
US-8431556-B2 C-21-keto lupane derivatives preparation and use thereof VERTEX PHARMACEUTICALS INCORPORATED (US) 2013-04-30 US disclosed
EP-2411393-A1 FUSED PYRIMIDINE-DIONE DERIVATIVES AS TRPA1 MODULATORS Glenmark Pharmaceuticals S.A. (CH) 2012-02-01 EP disclosed
WO-2011132017-A1 PYRIDO[3,4-D]PYRIMIDINYL ACETAMIDE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-10-27 WO disclosed
US-20110077228-A1 NOVEL C-21-KETO LUPANE DERIVATIVES PREPARATION AND USE THEREOF MOINET CHRISTOPHE 2011-03-31 US disclosed
CN-1930134-B Use of pyrimidine compounds for the preparation of parasiticides NOVARTIS AG 2010-06-16 CN disclosed
CN-1930134-A Use of pyrimidine compounds for the preparation of parasiticides NOVARTIS AG (CH) 2007-03-14 CN disclosed
EP-0630244-A1 MUSCARINIC AGONISTS THE UNIVERSITY OF TOLEDO (US) 1994-12-28 EP disclosed
WO-1993003726-A1 MUSCARINIC AGONISTS THE UNIVERSITY OF TOLEDO (US) 1993-03-04 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-11737463-B2 Pyridine and pyrazine compounds NDUFS5, IL5, NDUFS4 CA2 1798/4885HCAR2 3288/4885HTT 2661/4885
US-20250129091-A1 THIENOPYRROLOTRIAZINE COMPOUNDS, THEIR PREPARATION AND THEIR THERAPEUTIC USE TPMT, TYMP, TBXA2R CA2 3131/4885HCAR2 831/4885HTT 426/4885
US-20230416205-A1 COMPOUNDS, COMPOSITIONS, AND METHODS NLRP3, NLRP1, NOD1 CA2 3734/4885HCAR2 829/4885HTT 3966/4885
US-20240336592-A1 PHENYL- AND PYRIDOPYRAZOLE DERIVATIVES AS INHIBITORS OF DDR1 DDR1, DDR2, DDRGK1 CA2 4854/4885HCAR2 1997/4885HTT 3544/4885
US-20110077228-A1 NOVEL C-21-KETO LUPANE DERIVATIVES PREPARATION AND USE THEREOF CYP51A1, CYP17A1, HSD17B7 CA2 2643/4885HCAR2 1165/4885HTT 4613/4885

“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.