SCHEMBL9010087

SCHEMBL9010087

O=P(O)(O)c1cccc2c1[CH]c1ccccc1-2

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTK2B Q14289 5/20 0.36
POLB P06746 4/20 0.36
NPC1 O15118 2/20 0.36
ALDH1A1 P00352 2/20 0.35
RAB9A P51151 1/20 0.35
CA2 P00918 1/20 0.34
CA4 P22748 1/20 0.34
CA5A P35218 1/20 0.34
ALPG P10696 1/20 0.34
RXFP1 Q9HBX9 1/20 0.34
MAPT P10636 2/20 0.33
GPR84 Q9NQS5 2/20 0.31
KDM4E B2RXH2 2/20 0.31
MEN1 O00255 1/20 0.31
LMNA P02545 1/20 0.31
BCHE P06276 1/20 0.31
PTPRC P08575 1/20 0.31
THRB P10828 1/20 0.31
PKM P14618 1/20 0.31
IDO1 P14902 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
SCHEMBL9010064 0.73 ELANE (0.33) PTK2BALDH1A1CA2CA4CA5A
SCHEMBL4956835 0.73 CA2 (0.48) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL246576 0.70 ALDH1A1 (0.39) POLBNPC1ALDH1A1RAB9ACA2
SCHEMBL29733396 0.70 CA2 (0.55) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL2173729 0.70 CA2 (0.55) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL232481 0.69 CA2 (0.44) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL30722355 0.69 CA2 (0.44) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL10791672 0.68 PTK2B (0.40) PTK2BPOLBNPC1ALDH1A1RAB9A
SCHEMBL6842140 0.68 HSD17B10 (0.50) POLBALDH1A1CA2CA4MAPT
SCHEMBL3192100 0.67 ALDH1A1 (0.48) POLBALDH1A1MAPTKDM4EMEN1

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
CN-117567490-A Organic boron fused ring compound containing 9, 9-aryl acridine and organic electroluminescent device 中国科学院长春应用化学研究所 2024-02-20 CN disclosed
EP-0741145-A1 Olefin polymerization catalyst and process for producing polyolefin using the same SUMITOMO CHEMICAL COMPANY LIMITED (JP) 1996-11-06 EP disclosed