SCHEMBL9788809

SCHEMBL9788809

CC(C(=O)c1ccccc1)C1CCCCC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
SCN1A P35498 1/20 0.49
SCN2A Q99250 1/20 0.49
SCN3A Q9NY46 1/20 0.49
MEN1 O00255 1/20 0.47
ALDH1A1 P00352 1/20 0.47
RECQL P46063 1/20 0.47
KMT2A Q03164 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
EPHX1 P07099 2/20 0.45
RAB9A P51151 3/20 0.44
NPC1 O15118 2/20 0.44
CHRM3 P20309 1/20 0.43
PGR P06401 1/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2B P18089 1/20 0.42
HTR2A P28223 1/20 0.42
HRH1 P35367 1/20 0.42

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
SCHEMBL2477876 1.00 LMNA (0.49) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7543000 0.95 LMNA (0.43) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL7493232 0.95 LMNA (0.43) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL17133910 0.91 PGR (0.46) LMNAALDH1A1KMT2ANPSR1NPC1
Iodide SCHEMBL6398171 0.89 PGR (0.44) LMNAALDH1A1KMT2ANPSR1NPC1
SCHEMBL2469981 0.84 NPC1 (0.54) LMNACYP1A2ALDH1A1KMT2AEPHX1
SCHEMBL29770503 0.81 NPC1 (0.46) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL17773026 0.81 HAO1 (0.51) ALDH1A1RAB9ANPC1PGRHPGD
SCHEMBL5605813 0.81 LMNA (0.46) LMNACYP1A2CYP2D6SCN1ASCN2A
SCHEMBL27721913 0.81 KMT2A (0.51) KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2013047396-A1 PATTERN FORMING METHOD, ELECTRON BEAM-SENSITIVE OR EXTREME ULTRAVIOLET-SENSITIVE COMPOSITION, RESIST FILM, METHOD FOR MANUFACTURING ELECTRONIC DEVICE USING THE SAME, AND ELECTRONIC DEVICE FUJIFILM CORPORATION (JP) 2013-04-04 WO disclosed
CN-100455635-C Uv light solidified paint capable of being used as optical fibre coating layer HAICHUAN INDUSTRY CO LTD (CN) 2009-01-28 CN disclosed
CN-1536040-A Uv light solidified paint capable of being used as optical fibre coating layer 深圳市海川实业股份有限公司 2004-10-13 CN disclosed
US-5032597-A Antitumor DU PONT MERCK PHARMACEUTICAL (US) 1991-07-16 US disclosed
EP-0133244-B1 PHENYLQUINOLINECARBOXYLIC ACIDS AND DERIVATIVES AS ANTITUMOR AGENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1990-12-05 EP disclosed
US-4680299-A ANTITUMOR AGENTS E.I. DU PONT DE NEMOURS AND COMPANY (US) 1987-07-14 US disclosed
EP-0133244-A2 Phenylquinolinecarboxylic acids and derivatives as antitumor agents E.I. DU PONT DE NEMOURS AND COMPANY (US) 1985-02-20 EP disclosed