SCHEMBL607770

SCHEMBL607770

Cc1ccc(-c2ncccn2)c(C(=O)O)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 1/20 0.50
HCRTR1 O43613 5/20 0.49
HCRTR2 O43614 5/20 0.49
KDM4E B2RXH2 2/20 0.48
HTT P42858 1/20 0.48
DHODH Q02127 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.46
TP53 P04637 1/20 0.46
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
POLB P06746 1/20 0.45
GFER P55789 1/20 0.45
GAA P10253 2/20 0.44
ALDH1A1 P00352 1/20 0.44
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA4 P22748 1/20 0.44
CA7 P43166 1/20 0.44
LMNA P02545 1/20 0.43
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL29683512 1.00 CSNK2A1 (0.50) CSNK2A1HCRTR1HCRTR2KDM4EHTT
SCHEMBL16656573 0.86 HCRTR1 (0.49) HCRTR1HCRTR2KMT2A
SCHEMBL11920220 0.86 CSNK2A1 (0.46) CSNK2A1KDM4EHTTDHODHSMN1; SMN2
SCHEMBL19241426 0.85 HCRTR1 (0.48) HCRTR1HCRTR2SMN1; SMN2
SCHEMBL16277289 0.84 ALDH1A1 (0.45) CSNK2A1HCRTR1HCRTR2KDM4EHTT
SCHEMBL1421933 0.82 CYP46A1 (0.64) HCRTR1HCRTR2KDM4EHTTTDP1
SCHEMBL29814525 0.82 KDM4E (0.47) CSNK2A1HCRTR1KDM4EHTTDHODH
SCHEMBL9955206 0.82 KDM4E (0.47) CSNK2A1HCRTR1KDM4EHTTDHODH
SCHEMBL4621112 0.81 CSNK2A1 (0.65) CSNK2A1KDM4ESMN1; SMN2MEN1KMT2A
SCHEMBL16803311 0.81 HCRTR2 (0.48) HCRTR1HCRTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2026106499-A1 OREXIN RECEPTOR ANTAGONISTS: 2-AZABICYCLIC COMPOUNDS BIAL - PORTELA & CA., S.A. (PT) 2026-05-21 WO claimed
CN-117820238-A Method for preparing 2- (2-pyrimidinyl) -5-methylbenzoic acid 苏州莱克施德药业有限公司 2024-04-05 CN claimed
CN-116635392-A Substituted azabicyclooctane compounds, intermediates thereof and methods of making 上海海雁医药科技有限公司 2023-08-22 CN claimed
WO-2022111683-A1 SUBSTITUTED AZABICYCLOOCTANE COMPOUND AND PREPARATION METHOD THEREFOR, AND INTERMEDIATE AND PREPARATION METHOD THEREFOR 上海海雁医药科技有限公司 2022-06-02 WO claimed
CN-112480107-A Substituted azabicyclooctane compounds, intermediates therefor and processes for their preparation 上海海雁医药科技有限公司 2021-03-12 CN claimed
WO-2026106499-A1 OREXIN RECEPTOR ANTAGONISTS: 2-AZABICYCLIC COMPOUNDS BIAL - PORTELA & CA., S.A. (PT) 2026-05-21 WO disclosed
CN-122010922-A Benzoxazole compounds, pharmaceutical compositions containing same and uses thereof 株洲千金药业股份有限公司 2026-05-12 CN disclosed
US-12583841-B2 Tetrahydropyrrolocyclic compound and application thereof Breakthrough Pharmaceuticals Inc. (CN) 2026-03-24 US disclosed
EP-4688154-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - Portela & Ca., S.A. (PT) 2026-02-11 EP disclosed
EP-4289834-B1 TETRAHYDROPYRROLOCYCLIC COMPOUND AND APPLICATION THEREOF MEDSHINE DISCOVERY INC (CN) 2025-11-26 EP disclosed
US-12378254-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators JANSSEN PHARMACEUTICA NV (BE) 2025-08-05 US disclosed
WO-2025023851-A1 MORPHOLINE OREXIN RECEPTOR ANTAGONISTS BIAL - PORTELA & CA., S.A. (PT) 2025-01-30 WO disclosed
US-20100168134-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2010-07-01 US disclosed
US-20100168134-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2010-07-01 US disclosed
US-20100168134-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS MERCK SHARP & DOHME LLC 2010-07-01 US disclosed
EP-2152690-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS Merck & Co., Inc. (US) 2010-02-17 EP disclosed
WO-2009143033-A1 PROCESS FOR THE PREPARATION OF AN OREXIN RECEPTOR ANTAGONIST MERCK & CO., INC. (US) 2009-11-26 WO disclosed
WO-2009143033-A1 PROCESS FOR THE PREPARATION OF AN OREXIN RECEPTOR ANTAGONIST MERCK & CO., INC. (US) 2009-11-26 WO disclosed
WO-2008147518-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2008-12-04 WO disclosed
WO-2008147518-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS MERCK & CO., INC. (US) 2008-12-04 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 (3 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-12378254-B2 Disubstituted octahydropyrrolo[3,4-c]pyrroles as orexin receptor modulators HCRTR2, HCRTR1, OXTR CSNK2A1 4197/4885HCRTR1 2/4885HCRTR2 1/4885
US-20100168134-A1 PYRIDYL PIPERIDINE OREXIN RECEPTOR ANTAGONISTS HCRTR2, HCRTR1, OXTR CSNK2A1 3486/4885HCRTR1 2/4885HCRTR2 1/4885
US-12583841-B2 Tetrahydropyrrolocyclic compound and application thereof HCRTR2, HCRTR1, CRHR2 CSNK2A1 266/4885HCRTR1 2/4885HCRTR2 1/4885

“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.