SCHEMBL8798823

SCHEMBL8798823

c1ccc(-c2csc(-c3ccc[nH]3)n2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 7/20 0.56
▸ KMT2A Q03164 5/20 0.56
▸ AR P10275 1/20 0.56
▸ SREBF2 Q12772 1/20 0.53
▸ ALDH1A1 P00352 7/20 0.51
▸ RAB9A P51151 6/20 0.51
▸ MEN1 O00255 4/20 0.50
▸ MAPT P10636 3/20 0.50
▸ HPGD P15428 3/20 0.50
▸ CYP3A4 P08684 3/20 0.50
▸ TP53 P04637 2/20 0.50
▸ ALOX15 P16050 2/20 0.50
▸ BRCA1 P38398 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ TDP1 Q9NUW8 2/20 0.50
▸ MAPK1 P28482 1/20 0.50
▸ SMN1; SMN2 Q16637 4/20 0.49
▸ NPC1 O15118 3/20 0.49
▸ LMNA P02545 2/20 0.49
▸ POLB P06746 1/20 0.49

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
SCHEMBL8799909 0.86 CYP19A1 (0.57) KDM4EKMT2AARSREBF2ALDH1A1
SCHEMBL8799272 0.82 KDM4E (0.54) KDM4EKMT2AARALDH1A1MEN1
SCHEMBL10752291 0.82 CYP19A1 (0.60) KDM4EKMT2ASREBF2ALDH1A1RAB9A
SCHEMBL6195426 0.80 GAA (0.65) KDM4EKMT2AALDH1A1RAB9AMEN1
SCHEMBL9343030 0.80 ALDH1A1 (0.58) KDM4EKMT2AARALDH1A1MEN1
SCHEMBL6200227 0.80 AR (0.52) KDM4EKMT2AARSREBF2ALDH1A1
SCHEMBL2781370 0.78 KDM4E (0.85) KDM4EKMT2AARSREBF2ALDH1A1
SCHEMBL11212983 0.76 SREBF2 (0.82) KDM4EKMT2AARSREBF2ALDH1A1
SCHEMBL11213828 0.76 SREBF2 (0.82) KDM4EKMT2AARSREBF2ALDH1A1
SCHEMBL11215130 0.76 SREBF2 (0.82) KDM4EKMT2AARSREBF2ALDH1A1

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-0554956-B1 Thiazolylpyrroles having a fungicidal activity MINI RICERCA SCIENT TECNOLOG (IT) 1997-10-01 — — EP claimed
US-5334605-A Agricultural uses MINISTERO DELL'UNIVERSITA' E DELLA RICERCA SCIENTIFICA E (IT) 1994-08-02 — — US claimed
EP-0554956-A1 Thiazolylpyrroles having a fungicidal activity MINISTERO DELL' UNIVERSITA' E DELLA RICERCA SCIENTIFICA E TECNOLOGICA (IT) 1993-08-11 — — EP claimed
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