SCHEMBL24793478

SCHEMBL24793478

NCc1ccc(-c2ncccc2F)cc1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADRB2 P07550 1/20 0.56
▸ CYP2A6 P11509 1/20 0.47
▸ HRH3 Q9Y5N1 1/20 0.45
▸ TAAR1 Q96RJ0 5/20 0.44
▸ LOXL2 Q9Y4K0 4/20 0.43
▸ MAOB P27338 2/20 0.42
▸ TRPV1 Q8NER1 1/20 0.41
▸ ALOX5 P09917 1/20 0.40
▸ GABRA1 P14867 2/20 0.39
▸ GABRG2 P18507 2/20 0.39
▸ GABRB3 P28472 2/20 0.39
▸ GABRA5 P31644 2/20 0.39
▸ GABRA3 P34903 2/20 0.39
▸ LTA4H P09960 1/20 0.38

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
SCHEMBL27174522 0.82 MKNK1 (0.47) TRPV1GABRA1GABRG2GABRB3GABRA5
SCHEMBL27174339 0.82 TRPV1 (0.41) ADRB2TRPV1GABRA1GABRG2GABRB3
SCHEMBL31521744 0.82 MKNK1 (0.47) TRPV1GABRA1GABRG2GABRB3GABRA5
SCHEMBL31306178 0.79 TRPV1 (0.43) TAAR1TRPV1GABRA1GABRG2GABRB3
SCHEMBL30007391 0.79 MAPK14 (0.53) TRPV1GABRA1GABRG2GABRB3GABRA5
SCHEMBL30211300 0.79 MAPK14 (0.53) TRPV1GABRA1GABRG2GABRB3GABRA5
SCHEMBL24792396 0.79 ADRB2 (0.56) ADRB2CYP2A6HRH3TAAR1LOXL2
SCHEMBL28242972 0.78 ADRB2 (0.59) ADRB2CYP2A6HRH3TAAR1LOXL2
SCHEMBL24791498 0.78 ADRB2 (0.51) ADRB2CYP2A6HRH3TAAR1MAOB
SCHEMBL2639667 0.77 FEN1 (0.43) CYP2A6TRPV1GABRA1GABRG2GABRB3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117940427-A Substituted pyrazolo [1,5-a ] pyrimidine-7-amine compounds as CDK inhibitors and therapeutic uses thereof 卡里克治疗有限公司 2024-04-26 — — CN disclosed
EP-4355426-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2024-04-24 — — EP disclosed
WO-2022263604-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2022-12-22 — — WO disclosed
WO-2022263604-A1 SUBSTITUTED PYRAZOLO[1,5-A]PYRIMIDINE-7-AMINE COMPOUNDS AS CDK INHIBITORS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2022-12-22 — — WO disclosed
Send feedback