SCHEMBL2980698

SCHEMBL2980698

O=C(c1ccccc1)c1ccc(C(Cl)(Cl)Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.61
SRD5A2 P31213 4/20 0.58
TSHR P16473 1/20 0.54
L3MBTL1 Q9Y468 2/20 0.52
ATM Q13315 1/20 0.52
TDP1 Q9NUW8 1/20 0.52
RAB9A P51151 3/20 0.52
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
NPC1 O15118 2/20 0.52
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
MAPK13 O15264 1/20 0.50
MAPK12 P53778 1/20 0.50
MAPK11 Q15759 1/20 0.50
MAPK14 Q16539 1/20 0.50
HPGD P15428 1/20 0.48
FFAR1 O14842 1/20 0.47
ELANE P08246 2/20 0.47
CES2 O00748 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
SCHEMBL3701394 0.91 SRD5A2 (0.50) ALDH1A1SRD5A2TSHRLMNAMAPT
SCHEMBL677086 0.83 ALDH1A1 (0.56) ALDH1A1SRD5A2L3MBTL1ATMTDP1
SCHEMBL7929201 0.83 LMNA (0.65) SRD5A2L3MBTL1TDP1RAB9AMEN1
SCHEMBL11395047 0.82 ALDH1A1 (0.67) ALDH1A1SRD5A2L3MBTL1ATMTDP1
Benzophenone SCHEMBL6662205 0.81 ALDH1A1 (0.82) ALDH1A1SRD5A2TSHRL3MBTL1ATM
SCHEMBL7940776 0.81 LTA4H (0.53) ALDH1A1SRD5A2TSHRRAB9ANPC1
SCHEMBL9776307 0.81 SRD5A2 (0.68) SRD5A2TSHRRAB9AMEN1KMT2A
Benzophenone SCHEMBL31040259 0.81 ALDH1A1 (0.93) ALDH1A1SRD5A2TSHRL3MBTL1ATM
SCHEMBL9066312 0.81 ALDH1A1 (0.93) ALDH1A1SRD5A2TSHRL3MBTL1ATM
SCHEMBL314267 0.81 ALDH1A1 (0.93) ALDH1A1SRD5A2TSHRL3MBTL1ATM

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4180674-A ONE STEP ESTERIFICATION OF TRICHLOROMETHYL BENZOPHENONES STAUFFER CHEMICAL COMPANY (US) 1979-12-25 US claimed
EP-0000502-A1 Process for preparing butyl-p-benzoylbenzoates STAUFFER CHEMICAL COMPANY (US) 1979-02-07 EP claimed
US-7780279-B2 Radiation-curable inks FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-08-24 US disclosed
US-20070142493-A1 Radiation-curable inks AVECIA LIMITED (GB) 2007-06-21 US disclosed
EP-1678264-B1 RADIATION-CURABLE INKS FUJIFILM IMAGING COLORANTS LTD (GB) 2007-04-04 EP disclosed
EP-1678264-A1 RADIATION-CURABLE INKS FUJIFILM Imaging Colorants Limited (GB) 2006-07-12 EP disclosed
EP-1412441-B8 RADIATION CURABLE POLYMERIC INK COMPOSITIONS CYTEC SURFACE SPECIALTIES SA (BE) 2005-11-23 EP disclosed
EP-1412441-B1 RADIATION CURABLE POLYMERIC INK COMPOSITIONS SURFACE SPECIALTIES SA (BE) 2005-09-14 EP disclosed
WO-2005044937-A1 RADIATION-CURABLE INKS FUJIFILM IMAGING COLORANTS LIMITED (GB) 2005-05-19 WO disclosed
CN-1589300-A Radiation-curable polyurethane dispersion UCB SA (BE) 2005-03-02 CN disclosed
US-20040242763-A1 Radiation-curable polyurethane dispersion SURFACE SPECIALTIES, S.A. (BE) 2004-12-02 US disclosed
US-4180674-A ONE STEP ESTERIFICATION OF TRICHLOROMETHYL BENZOPHENONES STAUFFER CHEMICAL COMPANY (US) 1979-12-25 US disclosed
US-4141806-A MULTISTAGE, TEMPERATURE BAYER AKTIENGESELLSCHAFT (DE) 1979-02-27 US disclosed
EP-0000705-A1 Use of esters or amides of benzoylbenzoic acids as photoinitiators and photopolymerisable composition containing them STAUFFER CHEMICAL COMPANY (US) 1979-02-21 EP disclosed
EP-0000502-A1 Process for preparing butyl-p-benzoylbenzoates STAUFFER CHEMICAL COMPANY (US) 1979-02-07 EP disclosed
EP-0000502-A1 Process for preparing butyl-p-benzoylbenzoates STAUFFER CHEMICAL COMPANY (US) 1979-02-07 EP disclosed
US-4134814-A Halogenated photopolymerizable adhesives UCB, SOCIETE ANONYME (BE) 1979-01-16 US disclosed
US-4134811-A Halogenated photopolymerizable compositions UCB, SOCIETE ANONYME (BE) 1979-01-16 US disclosed
US-4107012-A COATINGS, PRINTING INKS BAYER AKTIENGESELLSCHAFT (DE) 1978-08-15 US disclosed
US-4080275-A POLYMERIZATION INITIATOR, ETHYLENICALLY UNSATURATED MONOMER STAUFFER CHEMICAL COMPANY (US) 1978-03-21 US disclosed