SCHEMBL31568103

SCHEMBL31568103

COc1ccc(SCC(C)(C)C)cc1Cl

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.41
▸ NPC1 O15118 2/20 0.41
▸ ALDH1A1 P00352 5/20 0.41
▸ LMNA P02545 1/20 0.41
▸ KMT2A Q03164 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ AR P10275 5/20 0.39
▸ TTR P02766 1/20 0.39
▸ MAPT P10636 6/20 0.38
▸ HPGD P15428 3/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ CYP2C9 P11712 2/20 0.38
▸ CYP2C19 P33261 2/20 0.38
▸ USP2 O75604 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ GFER P55789 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
SCHEMBL31568122 0.81 AR (0.40) ALDH1A1ARMAPTHPGDCYP2C9
SCHEMBL31568121 0.79 ALDH1A1 (0.42) RAB9AALDH1A1LMNAKMT2AMEN1
SCHEMBL8832774 0.77 RAB9A (0.44) RAB9ANPC1ALDH1A1LMNAKMT2A
SCHEMBL8863220 0.76 LMNA (0.46) RAB9ANPC1ALDH1A1LMNAKMT2A
SCHEMBL12932841 0.73 PTGS2 (0.44) MAPTL3MBTL1HTTCYP1A2CYP3A4
SCHEMBL9917309 0.71 KMT2A (0.53) ALDH1A1KMT2AMEN1TTRMAPT
SCHEMBL10644798 0.71 MAOA (0.43) RAB9ANPC1ALDH1A1KMT2AMEN1
SCHEMBL12933383 0.70 MTNR1A (0.50) ALDH1A1CYP2C9CYP2C19CYP1A2CYP2E1
SCHEMBL13918976 0.69 GRM5 (0.47) MAPTL3MBTL1POLBMAPK1HTT
SCHEMBL13220725 0.69 KMT2A (0.50) ALDH1A1KMT2AMEN1TTRMAPT

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-119894875-A [4- [5- (Methylsulfonyl) -phenyl ] piperazin-1-yl ] - (phenyl) methanone derivatives and similar compounds having gfrα1-RET activity as neuroprotective agents for the treatment of neurological disorders 基因密码公司 2025-04-25 — — CN disclosed
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