SCHEMBL9834177

SCHEMBL9834177

CCC(CCSc1ccc(Cl)cc1)(c1cccs1)N(C)C

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.42
▸ LMNA P02545 4/20 0.42
▸ ALDH1A1 P00352 4/20 0.42
▸ NPSR1 Q6W5P4 2/20 0.42
▸ KMT2A Q03164 2/20 0.42
▸ HPGD P15428 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ FDPS P14324 1/20 0.38
▸ RAB9A P51151 1/20 0.36
▸ CHKA P35790 1/20 0.33
▸ POLB P06746 2/20 0.32
▸ TP53 P04637 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ KDM4E B2RXH2 2/20 0.31
▸ PKM P14618 2/20 0.31
▸ HTT P42858 3/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ CYP2D6 P10635 1/20 0.31
▸ CYP2C9 P11712 1/20 0.31
▸ CYP2C19 P33261 1/20 0.31

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
SCHEMBL9831796 0.89 NPC1 (0.35) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL9831386 0.81 MAPT (0.45) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL9799293 0.79 FDPS (0.38) MAPTLMNAL3MBTL1FDPSRAB9A
SCHEMBL9833083 0.78 OPRM1 (0.40) MAPTLMNAALDH1A1KMT2AHPGD
SCHEMBL9832269 0.77 MAPT (0.36) MAPTLMNAALDH1A1KMT2AHPGD
SCHEMBL9833650 0.77 MAPT (0.41) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL9830678 0.70 RIPK1 (0.38) KMT2ATSHR
SCHEMBL9833086 0.69 NPC1 (0.38) MAPTLMNAALDH1A1NPSR1KMT2A
SCHEMBL9799280 0.69 SIGMAR1 (0.40) FDPSCYP1A2CYP2C9CYP2C19
Hydrochloric Acid SCHEMBL30082857 0.66 TRPM8 (0.38) MAPTLMNAALDH1A1KMT2ARAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0297782-B1 A THIOPHENE DERIVATIVE AND PROCESS FOR PREPARING THE SAME TANABE SEIYAKU CO., LTD. (JP) 1991-05-22 — — EP disclosed
US-4857543-A TREATMENT OF GASTROINTESTINAL DISORDERS TANABE SEIYAKU CO., LTD. (JP) 1989-08-15 — — US disclosed
EP-0297782-A1 A thiophene derivative and process for preparing the same TANABE SEIYAKU CO., LTD. (JP) 1989-01-04 — — EP disclosed
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