SCHEMBL30516645

SCHEMBL30516645

Cc1sccc1C(=O)NC1CCC12CCC2

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NAMPT P43490 1/20 0.39
▸ PTGDR Q13258 1/20 0.37
▸ HPGD P15428 2/20 0.36
▸ NPC1 O15118 5/20 0.36
▸ RAB9A P51151 5/20 0.36
▸ CRBN Q96SW2 1/20 0.36
▸ ATM Q13315 1/20 0.34
▸ ALPL P05186 1/20 0.33
▸ ALPI P09923 1/20 0.33
▸ ALPG P10696 1/20 0.33
▸ CCR8 P51685 1/20 0.33
▸ TAS1R3 Q7RTX0 1/20 0.33
▸ TAS1R1 Q7RTX1 1/20 0.33
▸ HSD17B10 Q99714 2/20 0.33
▸ LMNA P02545 1/20 0.33
▸ GLA P06280 1/20 0.33
▸ MAPK1 P28482 1/20 0.33
▸ CYP1A2 P05177 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL30516632 0.76 CNR2 (0.36) NAMPTPTGDRHPGDNPC1RAB9A
SCHEMBL30516660 0.75 TSHR (0.60) HPGDNPC1RAB9AATMTAS1R3
SCHEMBL30516670 0.73 NPC1 (0.49) HPGDNPC1RAB9AMAPK1SMN1; SMN2
SCHEMBL30516651 0.72 HDAC1 (0.50) PTGDRHPGDNPC1RAB9A
SCHEMBL31438387 0.72 NAMPT (0.40) NAMPTHPGDGRM1
SCHEMBL31001168 0.72 NAMPT (0.40) NAMPTHPGDGRM1
SCHEMBL31438405 0.69 TLR7 (0.42) —
SCHEMBL4774133 0.67 MAPK10 (0.51) NAMPTHPGDNPC1RAB9ALMNA
SCHEMBL31203422 0.67 KEAP1 (0.47) HPGDNPC1RAB9ALMNAMAPK1
SCHEMBL25607337 0.66 NAMPT (0.48) NAMPTHPGDNPC1RAB9AHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116529238-A Novel prostaglandin E 2 Compounds with receptor inhibiting activity and uses thereof 治纳辅医药科技有限公司 2023-08-01 — — CN disclosed
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