SCHEMBL17403389

SCHEMBL17403389

CCC(C)(C)c1ccc(CO)cn1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.33
▸ CA1 P00915 1/20 0.33
▸ CA2 P00918 1/20 0.33
▸ CA4 P22748 1/20 0.33
▸ CA6 P23280 1/20 0.33
▸ CA5A P35218 1/20 0.33
▸ CA7 P43166 1/20 0.33
▸ CA9 Q16790 1/20 0.33
▸ CA14 Q9ULX7 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ TKT P29401 1/20 0.33
▸ PTGS2 P35354 1/20 0.32
▸ NPC1 O15118 4/20 0.32
▸ RAB9A P51151 4/20 0.32
▸ SMN1; SMN2 Q16637 3/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ L3MBTL1 Q9Y468 2/20 0.32
▸ PPARG P37231 1/20 0.32
▸ PPARA Q07869 1/20 0.32
▸ POLB P06746 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
SCHEMBL12303328 0.85 KDM4E (0.41) CA2PTGS2NPC1RAB9ASMN1; SMN2
SCHEMBL619744 0.82 CCR9 (0.40) CA12CA1CA2CA4CA6
SCHEMBL1743280 0.79 TKT (0.39) CA12CA1CA2CA4CA6
SCHEMBL19413034 0.77 ESR1 (0.39) LMNA
SCHEMBL27460229 0.76 PTGS2 (0.32) CA12CA1CA2CA4CA6
SCHEMBL217684 0.75 CCR1 (0.43) RAB9AKDM4EMAPTALDH1A1MEN1
SCHEMBL17433153 0.75 NPC1 (0.39) NPC1RAB9ASMN1; SMN2MAPTATM
SCHEMBL17403395 0.75 TRPV4 (0.52) —
SCHEMBL29525326 0.75 TRPV4 (0.52) TKTCYP3A4
SCHEMBL132198 0.75 TRPV4 (0.52) TKTCYP3A4

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-9324604-B2 Gap-fill methods ROHM AND HAAS ELECTRONIC MATERIALS LLC (US) 2016-04-26 — — US disclosed
US-20160005641-A1 GAP-FILL METHODS U.S. BANK TRUST COMPANY, NATIONAL ASSOCIATION, AS NOTES COLLATERAL AGENT 2016-01-07 — — US disclosed
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