SCHEMBL11146556

SCHEMBL11146556

COc1c(Cl)ccc(S)c1Cl

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.44
▸ KDM4E B2RXH2 2/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ TSHR P16473 1/20 0.36
▸ HTR1A P08908 1/20 0.33
▸ HTR1D P28221 1/20 0.33
▸ HTR2C P28335 1/20 0.33
▸ HTR7 P34969 1/20 0.33
▸ HTR5A P47898 1/20 0.33
▸ L3MBTL1 Q9Y468 1/20 0.33
▸ TAS1R3 Q7RTX0 5/20 0.33
▸ TAS1R1 Q7RTX1 5/20 0.33
▸ MAPK1 P28482 1/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32
▸ ADRA1A P35348 1/20 0.32
▸ TAS1R2 Q8TE23 3/20 0.32
▸ CHUK O15111 1/20 0.32
▸ TUBB4A P04350 1/20 0.32
▸ TUBB P07437 1/20 0.32
▸ TUBA3C P0DPH7 1/20 0.32

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
SCHEMBL11144274 0.82 L3MBTL1 (0.40) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL2355429 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL29536407 0.80 ALDH1A1 (0.50) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL20431234 0.80 AMY1A (0.39) ALDH1A1KDM4EMAPK1HPGD
SCHEMBL1223611 0.77 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL9410517 0.74 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL10992767 0.73 ALDH1A1 (0.44) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL2091391 0.73 KDM4E (0.39) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL10209991 0.70 ALDH1A1 (0.45) ALDH1A1KDM4EHSD17B10TSHRHTR1A
SCHEMBL10726742 0.70 KDM4E (0.40) ALDH1A1KDM4EHTR2CL3MBTL1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4404220-A INSECTIDES VELSICOL CHEMICAL CORPORATION (US) 1983-09-13 — — US disclosed
US-4299772-A INSECTICIDES VELSICOL CHEMICAL CORPORATION (US) 1981-11-10 — — US disclosed
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