SCHEMBL7705602

SCHEMBL7705602

COc1cc[c]c(-c2ccc(C)cc2)c1-c1ccc(C)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACHE P22303 2/20 0.35
PDGFRB P09619 1/20 0.34
PDGFRA P16234 1/20 0.34
ALDH1A1 P00352 4/20 0.33
HPGD P15428 2/20 0.33
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 3/20 0.32
MAPT P10636 2/20 0.32
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
POLB P06746 1/20 0.32
NPC1 O15118 1/20 0.32
RAB9A P51151 1/20 0.32
TUBB4A P04350 1/20 0.32
TUBB P07437 1/20 0.32
TUBA3C P0DPH7 1/20 0.32
TUBA1B P68363 1/20 0.32
TUBA4A P68366 1/20 0.32
TUBB4B P68371 1/20 0.32

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
SCHEMBL7702832 0.84 MGAM (0.46) MGAMGAASIMGAM2
SCHEMBL7708151 0.84 CRHR1 (0.38) ALDH1A1KMT2AMAPTKDM4EMEN1
SCHEMBL7071376 0.84 PDE4B (0.39) ALDH1A1HPGDCYP3A4KMT2AMAPT
SCHEMBL7705593 0.81 TDO2 (0.35) ALDH1A1KMT2AMAPTMEN1SMN1; SMN2
SCHEMBL7702845 0.81 PDGFRB (0.38) PDGFRBPDGFRAALDH1A1HPGDCYP3A4
SCHEMBL7707636 0.79 ABCB1 (0.32)
SCHEMBL11802233 0.79 CYP1A2 (0.41) ALDH1A1KMT2AKDM4EMEN1GAA
SCHEMBL7708325 0.78 ALDH1A1 (0.37) ALDH1A1HPGDKMT2AMAPTKDM4E
SCHEMBL28506113 0.77 ACHE (0.33) ACHETDP1
SCHEMBL7702879 0.77 CA1 (0.39) ACHESMPD3MGAMGAASI

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-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed