SCHEMBL10737433

SCHEMBL10737433

CCCCCCn1c(S[Sn](c2ccccc2)(c2ccccc2)c2ccccc2)nc2ccccc2c1=O

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 2/20 0.64
▸ SMN1; SMN2 Q16637 2/20 0.53
▸ NPSR1 Q6W5P4 2/20 0.52
▸ MAPT P10636 2/20 0.48
▸ CYP3A4 P08684 2/20 0.48
▸ CYP2C9 P11712 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ ALDH1A1 P00352 6/20 0.48
▸ POLB P06746 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ TSHR P16473 2/20 0.47
▸ PTK2B Q14289 1/20 0.47
▸ LMNA P02545 1/20 0.46
▸ HPGD P15428 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ RXFP1 Q9HBX9 1/20 0.46

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
SCHEMBL10739938 0.95 TDP1 (0.57) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10739940 0.86 TDP1 (0.64) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10741313 0.84 NPSR1 (0.55) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10742041 0.81 SMN1; SMN2 (0.44) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10735119 0.81 TDP1 (0.57) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10740921 0.81 TDP1 (0.58) TDP1SMN1; SMN2NPSR1MAPTALDH1A1
SCHEMBL18029436 0.79 TDP1 (0.63) TDP1SMN1; SMN2NPSR1MAPTCYP3A4
SCHEMBL10741199 0.79 USP2 (0.57) TDP1SMN1; SMN2MAPTALDH1A1POLB
SCHEMBL14259780 0.76 TSHR (0.64) TDP1SMN1; SMN2NPSR1CYP2C9CYP2C19
SCHEMBL10526480 0.76 TSHR (0.74) TDP1SMN1; SMN2ALDH1A1KDM4EGAA

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-4652558-A FUNGICIDES, INSECTICIDES CHEVRON RESEARCH COMPANY (US) 1987-03-24 — — US disclosed
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