SCHEMBL31482535

SCHEMBL31482535

CCN1C(=O)/C(=C/c2ccc(OCCCN(C)C)cc2)SC1=S

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ DNM1 Q05193 2/20 1.00
▸ MCHR1 Q99705 1/20 0.61
▸ MAPK1 P28482 2/20 0.59
▸ AKR1B1 P15121 7/20 0.59
▸ IKBKB O14920 2/20 0.57
▸ MAPT P10636 2/20 0.56
▸ MITF O75030 1/20 0.56
▸ RAB9A P51151 1/20 0.56
▸ NCOA3 Q9Y6Q9 1/20 0.56
▸ PTPN1 P18031 3/20 0.54
▸ USP2 O75604 1/20 0.54
▸ ALDH1A1 P00352 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ S1PR1 P21453 1/20 0.54
▸ S1PR3 Q99500 1/20 0.54
▸ PDE4B Q07343 2/20 0.53
▸ PTPN2 P17706 1/20 0.52

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
SCHEMBL20006042 0.86 MAPK1 (0.78) DNM1MAPK1MAPTMITFRAB9A
SCHEMBL18103079 0.86 MAPK1 (0.78) DNM1MAPK1MAPTMITFRAB9A
SCHEMBL14407429 0.82 MAPT (0.70) DNM1MCHR1MAPK1MAPTNCOA3
SCHEMBL17319533 0.79 AKR1B1 (0.84) DNM1AKR1B1MAPTMITFRAB9A
SCHEMBL17319550 0.79 AKR1B1 (0.84) DNM1AKR1B1MAPTMITFRAB9A
SCHEMBL25994490 0.78 DNM1 (0.64) DNM1MAPK1AKR1B1MAPTMITF
SCHEMBL8203936 0.78 HPGD (0.69) DNM1MAPK1MAPTRAB9AALDH1A1
SCHEMBL8203940 0.78 HPGD (0.69) DNM1MAPK1MAPTRAB9AALDH1A1
SCHEMBL12008439 0.77 AKR1B1 (0.84) DNM1MAPK1AKR1B1MAPTMITF
SCHEMBL31482534 0.77 MEN1 (0.67) DNM1RAB9A

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
WO-2025068705-A1 METHOD OF PREPARING A NUCLEIC ACID SAMPLE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2025-04-03 — — WO claimed
WO-2025068705-A1 METHOD OF PREPARING A NUCLEIC ACID SAMPLE CANCER RESEARCH TECHNOLOGY LIMITED (GB) 2025-04-03 — — WO disclosed
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