SCHEMBL17499259

SCHEMBL17499259

CC(=Nc1ccccc1O[SiH](C)C)c1ccn(C)n1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.36
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
KMT2A Q03164 3/20 0.33
MEN1 O00255 2/20 0.33
TP53 P04637 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ALDH1A1 P00352 2/20 0.31
LMNA P02545 1/20 0.31
MAPT P10636 1/20 0.31
HSD17B10 Q99714 1/20 0.31
OPRM1 P35372 1/20 0.30
OPRL1 P41146 1/20 0.30
NOTUM Q6P988 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
SCHEMBL16101645 0.85 ALDH1A1 (0.43) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL17499229 0.84 TSHR (0.41) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL17499641 0.83 RAB9A (0.38) TSHRNPC1RAB9AKMT2AMEN1
SCHEMBL17499223 0.78 ALDH1A1 (0.30) RAB9ASMN1; SMN2ALDH1A1LMNAMAPT
SCHEMBL17499126 0.78 KDM4E (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL17499544 0.77 ALDH1A1 (0.32) ALDH1A1LMNAMAPTHSD17B10
SCHEMBL17499692 0.77 TDP1 (0.32) ALDH1A1LMNAMAPTHSD17B10
SCHEMBL17499296 0.77 ATM (0.38) NPC1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL17499663 0.76 ALDH1A1 (0.32) ALDH1A1LMNAMAPTHSD17B10
SCHEMBL17499253 0.75 NAMPT (0.34) TSHRRAB9AKMT2AMEN1TP53

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-9850328-B2 Polymers functionalized with heterocyclic imines BRIDGESTONE CORPORATION (JP) 2017-12-26 US disclosed
US-20160039958-A1 Polymers Functionalized With Heterocyclic Imines BRIDGESTONE CORPORATION (JP) 2016-02-11 US disclosed