SCHEMBL8666337

SCHEMBL8666337

Fc1ccc2ccccc2c1C1(C2(c3c(F)ccc4ccccc34)N=C(c3ccccc3)C(c3ccccc3)=N2)N=C(c2ccccc2)C(c2ccccc2)=N1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPRT1 P00492 2/20 0.36
MAPT P10636 3/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
LMNA P02545 2/20 0.35
NPC1 O15118 1/20 0.35
RECQL P46063 1/20 0.35
RAB9A P51151 1/20 0.35
CYP1A1 P04798 4/20 0.35
CYP1B1 Q16678 4/20 0.35
ACLY P53396 1/20 0.35
ALDH1A1 P00352 3/20 0.34
HSD17B10 Q99714 3/20 0.34
TDP1 Q9NUW8 3/20 0.34
TSHR P16473 2/20 0.34
CYP2A6 P11509 1/20 0.34
CYP1A2 P05177 5/20 0.34
HPGD P15428 2/20 0.34
THRB P10828 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL3394827 0.81 ALDH1A1 (0.35) SMN1; SMN2NPC1RAB9AALDH1A1TSHR
SCHEMBL8666425 0.81 POLB (0.37) HPRT1MAPTSMN1; SMN2LMNANPC1
SCHEMBL8665969 0.81 CYP2A6 (0.43) MAPTSMN1; SMN2LMNANPC1RECQL
SCHEMBL8668404 0.81 CYP2A6 (0.43) HPRT1MAPTSMN1; SMN2LMNANPC1
SCHEMBL8665239 0.77 MAPT (0.47) MAPTSMN1; SMN2LMNARAB9AALDH1A1
SCHEMBL8666981 0.76 MAPT (0.39) MAPTSMN1; SMN2LMNANPC1RECQL
SCHEMBL2689653 0.73 WDR5 (0.37) HPRT1MAPTSMN1; SMN2LMNANPC1
SCHEMBL8666970 0.73 ADORA2A (0.33) SMN1; SMN2NPC1RAB9AALDH1A1HPGD
SCHEMBL155813 0.68 ALDH1A1 (0.34) SMN1; SMN2NPC1RAB9AALDH1A1TSHR
SCHEMBL8667184 0.68 CYP1A2 (0.38) MAPTLMNARECQLCYP1A1CYP1B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5792589-A ORGANIC BINDER; OPTICALLY CROSSLINKABLE COMPOUND; RADICAL-GENERATING AGENT: 2,4,5-TRIARYL IMIDAZOLE DIMER, AMINO-GROUP CONTAINING BENZOPHENONE PHOTOSENSITIZER, A THIOL COMPOUND JAPAN SYNTHETIC RUBBER CO., LTD. (JP) 1998-08-11 US disclosed