SCHEMBL30933030

SCHEMBL30933030

COC(=O)C1C2CCCCC21

nearest known ligand 0.45

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PPM1B O75688 1/20 0.45
▸ PTPN1 P18031 1/20 0.45
▸ PPP1CC P36873 1/20 0.45
▸ ALOX15 P16050 1/20 0.42
▸ TSHR P16473 1/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ CYP2C19 P33261 1/20 0.39
▸ POLB P06746 2/20 0.38
▸ CHRM2 P08172 1/20 0.37
▸ CHRM4 P08173 1/20 0.37
▸ CHRM3 P20309 1/20 0.37
▸ NPSR1 Q6W5P4 1/20 0.36
▸ NPC1 O15118 2/20 0.36
▸ RAB9A P51151 2/20 0.36

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
SCHEMBL7354850 0.95 PPM1B (0.45) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL6551846 0.95 PPM1B (0.45) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL16448666 0.95 PPM1B (0.45) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL25277941 0.82 PPM1B (0.53) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL31010895 0.82 PPM1B (0.53) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL31010896 0.82 PPM1B (0.53) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL14357849 0.79 CHRM2 (0.42) PPM1BPTPN1PPP1CCSMN1; SMN2CYP2C19
SCHEMBL15653978 0.79 PPM1B (0.48) PPM1BPTPN1PPP1CCSMN1; SMN2CYP2C19
SCHEMBL19250496 0.76 CHRM2 (0.37) PPM1BPTPN1PPP1CCALOX15TSHR
SCHEMBL28042619 0.76 ADRA2A (0.39) ALOX15TSHRCYP2C19

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
US-20240392208-A1 CYCLOPROPANATED FRAGRANCE COMPOUNDS SYMRISE AG (DE) 2024-11-28 — — US disclosed
CN-117940541-A Cyclopropanated fragrance compounds 西姆莱斯有限公司 2024-04-26 — — CN disclosed
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