SCHEMBL4385697

SCHEMBL4385697

COc1ccc(-c2cccc3c2C(c2ccc(OC)cc2)c2ccccc2-3)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.51
TP53 P04637 2/20 0.51
MAPT P10636 2/20 0.51
RAB9A P51151 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
HPGD P15428 2/20 0.51
MAOA P21397 1/20 0.51
PTGS2 P35354 1/20 0.51
ABL1 P00519 1/20 0.46
ABCB1 P08183 1/20 0.46
BCR P11274 1/20 0.46
HDAC4 P56524 1/20 0.42
HDAC2 Q92769 1/20 0.42
HDAC8 Q9BY41 1/20 0.42
GAA P10253 1/20 0.40
EDNRA P25101 3/20 0.40
EDNRB P24530 2/20 0.40
TSHR P16473 1/20 0.40
SYK P43405 1/20 0.39
AURKB Q96GD4 1/20 0.39

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
SCHEMBL28108876 0.93 ABL1 (0.48) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL6828591 0.84 HPGD (0.65) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL8984742 0.83 MEN1 (0.47) NPC1MAPTRAB9AEDNRAEDNRB
SCHEMBL4272491 0.81 ESR1 (0.45) SMN1; SMN2GAACYP3A4ALDH1A1
SCHEMBL4270501 0.81 ESR1 (0.32) NPC1TP53MAPTRAB9ASMN1; SMN2
SCHEMBL1034459 0.81 HSD17B10 (0.38) TP53CYP3A4ALDH1A1
SCHEMBL573085 0.80 KMT2A (0.47) ABL1ABCB1BCRGAAKMT2A
SCHEMBL1289717 0.80 CHRNB2 (0.33) ALDH1A1
SCHEMBL5813609 0.79 ESR1 (0.40) HPGDALDH1A1KMT2A
SCHEMBL8981615 0.79 TSHR (0.34) NPC1MAPTRAB9AGAATSHR

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-7629429-B2 Aromatic resin; optical device; overcoating substrate with polymer; charge transfer compound, charge generating compoind CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2009-12-08 US disclosed
US-20040158017-A1 Substituted fluorene polymers their preparation and uses CAMBRIDGE DISPLAY TECHNOLOGY LIMITED (GB) 2004-08-12 US disclosed
EP-1385919-B1 SUBSTITUTED FLUORENE POLYMERS, THEIR PREPARATION AND USES CAMBRIDGE DISPLAY TECH LTD (GB) 2004-08-11 EP disclosed