SCHEMBL11609440

SCHEMBL11609440

SCc1ccc(C(c2ccc(CS)cc2)c2ccc(CS)cc2)cc1

nearest known ligand 0.50

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ IDO1 P14902 7/20 0.50
▸ CYP19A1 P11511 2/20 0.32
▸ TSHR P16473 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ ATM Q13315 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30

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
SCHEMBL127369 0.80 IDO1 (0.69) IDO1TSHRTDP1ESR1ESR2
SCHEMBL9344527 0.78 GFER (0.32) CYP19A1ESR1ESR2
SCHEMBL441726 0.71 IDO1 (0.58) IDO1TSHR
SCHEMBL17756332 0.71 IDO1 (0.58) IDO1TSHR
SCHEMBL17756329 0.71 IDO1 (0.58) IDO1TSHR
SCHEMBL635341 0.71 IDO1 (0.58) IDO1TSHRMAPK1TDP1ESR1
SCHEMBL13449879 0.71 IDO1 (0.44) IDO1TSHRMAPK1ATMTDP1
SCHEMBL9798184 0.71 CA1 (0.41) IDO1CYP19A1TSHRMAPK1ATM
SCHEMBL9396256 0.71 TSHR (0.48) TSHRESR1ESR2
SCHEMBL2491929 0.71 TSHR (0.58) IDO1TSHRMAPK1ATMTDP1

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
US-4067841-A ACRYLIC ESTER COPOLYMER STAUFFER CHEMICAL COMPANY (US) 1978-01-10 — — US disclosed
US-3997704-A ACRYLATE STAUFFER CHEMICAL COMPANY (US) 1976-12-14 — — US disclosed
US-3991135-A Polymer composition containing processing aid STAUFFER CHEMICAL COMPANY (US) 1976-11-09 — — US disclosed
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