SCHEMBL16587909

SCHEMBL16587909

CCc1ccc(F)cc1CF

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RIPK1 Q13546 3/20 0.37
▸ MAPT P10636 2/20 0.37
▸ PKM P14618 1/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ IDO1 P14902 2/20 0.36
▸ AGXT P21549 2/20 0.36
▸ HTR2A P28223 1/20 0.36
▸ SLC6A4 P31645 1/20 0.36
▸ KCNH2 Q12809 1/20 0.36
▸ KDM4E B2RXH2 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ TP53 P04637 1/20 0.35
▸ ALOX15 P16050 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ ACHE P22303 1/20 0.34
▸ PARK7 Q99497 1/20 0.34
▸ PSEN1 P49768 1/20 0.33
▸ PSEN2 P49810 1/20 0.33

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
SCHEMBL8418213 0.91 RIPK1 (0.37) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL3667517 0.88 IDO1 (0.40) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL14939746 0.80 KCNH2 (0.38) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL13548272 0.80 MAPT (0.39) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL12525261 0.80 MPO (0.43) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL12464215 0.79 MAPT (0.39) MAPTSMN1; SMN2KDM4EHTTHSD17B10
SCHEMBL28538413 0.78 IDO1 (0.38) RIPK1MAPTPKMSMN1; SMN2IDO1
SCHEMBL31021755 0.77 IDO1 (0.36) SMN1; SMN2IDO1AGXTKDM4EPSEN1
SCHEMBL12926917 0.77 MPO (0.44) SMN1; SMN2IDO1AGXTHTR2AKDM4E
SCHEMBL15256477 0.77 DHFR (0.38) MAPTSMN1; SMN2SLC6A4KDM4ELMNA

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
WO-2016174551-A1 ANTI-ESTROGENIC COMPOUNDS PFIZER INC. (US) 2016-11-03 — — WO disclosed
US-8987473-B2 Ring-fused compound SATO PHARMACEUTICAL CO., LTD. (JP) 2015-03-24 — — US disclosed
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