Sugi Predict

Sugi Predict / Compounds / SCHEMBL9217701

SCHEMBL9217701

SCHEMBL9217701

c1ccc(-c2nc(SCCCCCSc3nc(-c4ccccc4)c(-c4ccccc4)[nH]3)[nH]c2-c2ccccc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ACAT1 P24752 1/20 0.66
▸ SOAT1 P35610 1/20 0.66
▸ KDM4E B2RXH2 1/20 0.62

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
SCHEMBL9212895 1.00 ACAT1 (0.66) ACAT1SOAT1KDM4E
SCHEMBL9213347 1.00 ACAT1 (0.66) ACAT1SOAT1KDM4E
SCHEMBL9210387 0.98 KDM4E (0.64) ACAT1SOAT1KDM4E
SCHEMBL9215059 0.95 KDM4E (0.64) KDM4E
SCHEMBL8103993 0.93 — —
SCHEMBL9370570 0.93 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL9209249 0.93 ACAT1 (0.60) ACAT1SOAT1
SCHEMBL9218428 0.92 ACAT1 (0.59) ACAT1SOAT1KDM4E
SCHEMBL9215071 0.92 KDM4E (0.68) KDM4E
SCHEMBL9664375 0.91 ACAT1 (0.58) ACAT1SOAT1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0505468-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS ACYL COENZYME-A INHIBITORS RHONE POULENC SANTE (FR) 1995-04-26 — — EP claimed
EP-0505468-B1 IMIDAZOLE DERIVATIVES AND THEIR USE AS ACYL COENZYME-A INHIBITORS RHONE POULENC SANTE (FR) 1995-04-26 — — EP disclosed
EP-0505468-A1 IMIDAZOLES. RHONE POULENC SANTE (FR) 1992-09-30 — — EP disclosed
WO-1991009021-A1 IMIDAZOLES RHONE-POULENC SANTE (FR) 1991-06-27 — — WO disclosed