SCHEMBL365267

SCHEMBL365267

c1ccc(OCC2CC2)nc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR39 O43194 1/20 0.43
PDE5A O76074 1/20 0.41
PDE4A P27815 1/20 0.41
PDE4B Q07343 1/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
NPC1 O15118 2/20 0.41
ALDH1A1 P00352 2/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
RIPK1 Q13546 1/20 0.41
KDM1A O60341 1/20 0.41
DRD4 P21917 2/20 0.41
CNR2 P34972 1/20 0.40
KDM4E B2RXH2 2/20 0.39
LMNA P02545 2/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CCR1 P32246 1/20 0.39
CCR5 P51681 1/20 0.39

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
SCHEMBL31192198 1.00 GPR39 (0.43) GPR39PDE5APDE4APDE4BPDE4C
SCHEMBL17784680 0.92 FFAR1 (0.44) NPC1ALDH1A1CYP2D6CYP2C19KDM1A
SCHEMBL5513890 0.91 HTR2C (0.42) GPR39PDE5APDE4APDE4BPDE4C
SCHEMBL5513885 0.91 HTR2C (0.42) GPR39PDE5APDE4APDE4BPDE4C
SCHEMBL15130036 0.91 CTSL (0.45) NPC1CNR2HPGDRAB9A
Water SCHEMBL2649402 0.90 CNR2 (0.38) GPR39PDE5APDE4APDE4BPDE4C
SCHEMBL10499108 0.88 KDM1A (0.56) KDM1A
SCHEMBL20070282 0.85 HRH3 (0.49)
SCHEMBL27947518 0.84 CTSL (0.41) NPC1CNR2HPGDRAB9A
SCHEMBL4958459 0.83 MKNK1 (0.39) NPC1ALDH1A1CYP2D6CYP2C19KDM1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250179061-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF Sironax Ltd. (KY) 2025-06-05 US disclosed
CN-105189515-B Furopyridine class as bromine structural domain inhibitor 葛兰素史克知识产权第二有限公司 2018-07-03 CN disclosed
CN-108137513-A Pyrimidine derivatives ASKA 制药株式会社 2018-06-08 CN disclosed
CN-107207444-A Bicyclic compound 武田药品工业株式会社 2017-09-26 CN disclosed
EP-2545055-B1 Imidazo[1,2-a]pyrazine derivatives and their use for the prevention or treatment of neurological, psychiatric and metabolic disorders and diseases JANSSEN PHARMACEUTICA NV (BE) 2017-08-09 EP disclosed
CN-104039944-B Encapsulated benefit agent 荷兰联合利华有限公司 2017-04-26 CN disclosed
CN-106458984-A 5, 6-disubstituted pyridine-2-carboxamides as cannabinoid receptor agonists 豪夫迈·罗氏有限公司 2017-02-22 CN disclosed
CN-105392777-A Biaryl derivatives as GRP120 agonists LG LIFE SCIENCES LTD 2016-03-09 CN disclosed
CN-105121436-A Novel pyridine derivatives HOFFMANN LA ROCHE 2015-12-02 CN disclosed
US-9102621-B2 Acyl sulfonamide compounds PFIZER LIMITED (GB) 2015-08-11 US disclosed
WO-2014060395-A1 SERINE/THREONINE KINASE INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2014-04-24 WO disclosed
US-8592629-B2 Sulfonamide derivatives as Nav 1.7 inhibitors PFIZER LIMITED (GB) 2013-11-26 US disclosed
WO-2013102826-A1 N-AMINOSULFONYL BENZAMIDES PFIZER LIMITED (GB) 2013-07-11 WO disclosed
EP-2593432-A1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS Pfizer Limited (GB) 2013-05-22 EP disclosed
US-20130109708-A1 Chemical Compounds PFIZER LIMITED (GB) 2013-05-02 US disclosed
WO-2012007861-A1 N-SULFONYLBENZAMIDE DERIVATIVES USEFUL AS VOLTAGE GATED SODIUM CHANNEL INHIBITORS PFIZER LIMITED (GB) 2012-01-19 WO disclosed
US-20120010183-A1 Chemical Compounds PFIZER LIMITED (GB) 2012-01-12 US disclosed
US-20120010247-A1 BICYCLIC COMPOUND TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2012-01-12 US disclosed
EP-2351743-A1 BICYCLIC COMPOUND Takeda Pharmaceutical Company Limited (JP) 2011-08-03 EP disclosed
US-20100311748-A1 HETEROCYCLIC AMIDES USEFUL FOR THE TREATMENT OF CANCER AND PSORIASIS ASTRAZENECA AB (SE) 2010-12-09 US 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-20120010247-A1 BICYCLIC COMPOUND ACACA, CPT1B, ACACB GPR39 1972/4885PDE5A 1750/4885PDE4A 3278/4885
US-20130109708-A1 Chemical Compounds SCN1A, SCN1B, SCN7A GPR39 2091/4885PDE5A 2314/4885PDE4A 2977/4885
US-20250179061-A1 RIP1 MODULATORS, PREPARATIONS, AND USES THEREOF RIPK1, RIPK2, RIPK3 GPR39 2649/4885PDE5A 4339/4885PDE4A 3514/4885
US-20120010183-A1 Chemical Compounds SCN1A, SCN1B, SCN7A GPR39 1639/4885PDE5A 1956/4885PDE4A 1993/4885
US-20100311748-A1 HETEROCYCLIC AMIDES USEFUL FOR THE TREATMENT OF CANCER AND PSORIASIS SHH, GLI1, HRH4 GPR39 371/4885PDE5A 1131/4885PDE4A 1175/4885

“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.