SCHEMBL7935384

SCHEMBL7935384

O=C(c1ccccc1)c1ccc(Sc2ccc(F)cc2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.54
LMNA P02545 4/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ALPG P10696 1/20 0.54
ALDH1A1 P00352 5/20 0.54
SRD5A2 P31213 1/20 0.52
L3MBTL1 Q9Y468 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
USP2 O75604 1/20 0.50
HTT P42858 1/20 0.50
LTA4H P09960 1/20 0.50
GLA P06280 1/20 0.50
TDP1 Q9NUW8 2/20 0.47
ATM Q13315 1/20 0.47
RAB9A P51151 3/20 0.46
NPC1 O15118 2/20 0.46
MEN1 O00255 2/20 0.46
KMT2A Q03164 2/20 0.46
MAPT P10636 1/20 0.46
MAPK13 O15264 1/20 0.46

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
SCHEMBL14647716 1.00 HPGD (0.54) HPGDLMNASMN1; SMN2ALPGALDH1A1
SCHEMBL8429008 0.92 LTA4H (0.57) HPGDLMNASMN1; SMN2ALPGALDH1A1
SCHEMBL1127927 0.90 ALDH1A1 (0.49) HPGDLMNASMN1; SMN2ALPGALDH1A1
SCHEMBL6787662 0.90 ALDH1A1 (0.67) HPGDLMNASMN1; SMN2ALDH1A1SRD5A2
SCHEMBL17828242 0.90 ALDH1A1 (0.67) HPGDLMNASMN1; SMN2ALDH1A1SRD5A2
SCHEMBL17828245 0.90 ALDH1A1 (0.67) HPGDLMNASMN1; SMN2ALDH1A1SRD5A2
SCHEMBL385623 0.88 ALDH1A1 (0.67) HPGDLMNAALDH1A1SRD5A2L3MBTL1
SCHEMBL21506865 0.88 ALDH1A1 (0.67) HPGDLMNAALDH1A1SRD5A2L3MBTL1
SCHEMBL7940606 0.88 ALDH1A1 (0.70) HPGDLMNASMN1; SMN2ALPGALDH1A1
SCHEMBL251921 0.88 ALDH1A1 (0.70) HPGDLMNASMN1; SMN2ALPGALDH1A1

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-6242654-B1 REACTING A PHENOLATE COMPOUND WITH AN ORGANIC FLUORINATING AGENT TO PREPARE A FLUORINE SUBSTITUTED AROMATIC COMPOUND MITSUI CHEMICALS, INC. (JP) 2001-06-05 US disclosed
EP-1013629-A1 Preparation process of fluorine subsituted aromatic compound Mitsui Chemicals, Inc. (JP) 2000-06-28 EP disclosed