SCHEMBL30462090

SCHEMBL30462090

CNc1nc(-c2ccccc2C(C)C)ncc1OC

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ USP1 O94782 14/20 0.58
▸ WDR48 Q8TAF3 14/20 0.58
▸ PIP4K2C Q8TBX8 1/20 0.48
▸ TRPM8 Q7Z2W7 3/20 0.48
▸ LMNA P02545 2/20 0.48
▸ SMN1; SMN2 Q16637 2/20 0.48
▸ MITF O75030 1/20 0.48
▸ MAPT P10636 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ALDH1A1 P00352 2/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ HSD17B10 Q99714 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ KDM4E B2RXH2 1/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ TSHR P16473 1/20 0.45
▸ MAPK1 P28482 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45

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
SCHEMBL26627798 1.00 USP1 (0.58) USP1WDR48PIP4K2CTRPM8LMNA
SCHEMBL26627842 0.81 P2RX3 (0.51) USP1WDR48
SCHEMBL30462096 0.81 P2RX3 (0.51) USP1WDR48
SCHEMBL31423632 0.75 USP1 (0.75) USP1WDR48PIP4K2C
SCHEMBL31423562 0.74 USP1 (0.70) USP1WDR48
SCHEMBL31423660 0.74 USP1 (0.65) USP1WDR48
SCHEMBL31423519 0.74 USP1 (0.67) USP1WDR48PIP4K2C
SCHEMBL23837648 0.73 TRPM8 (0.73) TRPM8LMNASMN1; SMN2MITFMAPT
SCHEMBL31423616 0.73 TRPM8 (0.64) USP1WDR48PIP4K2CTRPM8LMNA
SCHEMBL31423567 0.72 USP1 (0.66) USP1WDR48PIP4K2CTRPM8LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118660872-A Pyrimidine compound, preparation method and medical application thereof 江苏亚虹医药科技股份有限公司 2024-09-17 — — CN disclosed
CN-116496252-A Pyrimidine compound, preparation method and medical application thereof 江苏亚虹医药科技股份有限公司 2023-07-28 — — CN disclosed
Send feedback