SCHEMBL8892878

SCHEMBL8892878

Cc1cc2c(cc1C)S[C](N)N2

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.32
▸ CYP3A4 P08684 1/20 0.32
▸ TSHR P16473 1/20 0.32
▸ MAPT P10636 2/20 0.31
▸ ALDH1A1 P00352 2/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HPGD P15428 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ SNCA P37840 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ GAA P10253 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ NOX1 Q9Y5S8 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
SCHEMBL24439558 0.69 NOX1 (0.67) MAPK1CYP3A4TSHRMAPTALDH1A1
SCHEMBL10532249 0.67 MAOA (0.49) MAPK1CYP3A4MAPTALDH1A1LMNA
SCHEMBL14606163 0.65 — —
SCHEMBL3292670 0.64 NOX1 (0.65) MAPK1CYP3A4MAPTALDH1A1KDM4E
SCHEMBL14467552 0.64 HPGD (0.42) MAPK1CYP3A4TSHRMAPTALDH1A1
SCHEMBL11427006 0.64 CYP3A4 (0.35) MAPK1CYP3A4TSHRALDH1A1KDM4E
SCHEMBL14433978 0.63 EPHX2 (0.62) MAPK1MAPTALDH1A1KDM4ELMNA
SCHEMBL11765386 0.63 NOX1 (0.36) MAPK1CYP3A4MAPTLMNASNCA
SCHEMBL18913249 0.56 ALDH1A1 (0.35) TSHRALDH1A1NOX1
SCHEMBL24255127 0.56 MAPT (0.50) MAPK1CYP3A4TSHRMAPTALDH1A1

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
US-5593993-A VIRICIDES FOR HTLV TREATMENT OF AIDS MEDIVIR AB (SE) 1997-01-14 — — US disclosed
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