SCHEMBL9648043

SCHEMBL9648043

Cc1ccc(C(=O)C(=O)c2ccc(Cl)cc2Cl)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.67
CES1 P23141 4/20 0.67
MAPT P10636 6/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
RAB9A P51151 4/20 0.57
HPGD P15428 3/20 0.57
NPC1 O15118 3/20 0.57
KMT2A Q03164 4/20 0.55
KDM4E B2RXH2 3/20 0.55
HTT P42858 3/20 0.55
LMNA P02545 2/20 0.55
CRHBP P24387 1/20 0.55
CRHR2 Q13324 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
FLT1 P17948 1/20 0.52
FLT4 P35916 1/20 0.52
KDR P35968 1/20 0.52
TSHR P16473 1/20 0.52
CASP1 P29466 1/20 0.52
SRD5A2 P31213 1/20 0.50

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
SCHEMBL4076070 0.89 CES2 (0.64) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL10890102 0.85 MAPT (0.53) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL4346543 0.84 SRD5A2 (0.70) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL8065539 0.83 SMN1; SMN2 (0.71) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL9749593 0.82 CES1 (0.62) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL7978621 0.82 FLT1 (0.56) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL2156105 0.81 CES2 (1.00) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL5366177 0.81 POLB (0.54) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL5366180 0.81 POLB (0.54) CES2CES1MAPTSMN1; SMN2RAB9A
SCHEMBL28799107 0.80 CES2 (0.62) CES2CES1MAPTSMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0362638-B1 METHOD OF PREPARING SYMMETRICAL AND UNSYMMETRICAL MONOACETALS OF AROMATIC 1,2-DIKETONES BASF Aktiengesellschaft (DE) 1992-12-02 EP disclosed
EP-0362638-A2 Method of preparing symmetrical and unsymmetrical monoacetals of aromatic 1,2-diketones BASF Aktiengesellschaft (DE) 1990-04-11 EP disclosed
US-4287367-A Manufacture of symmetrical or unsymmetrical monoacetals of aromatic 1,2-diketones BASF AKTIENGESELLSCHAFT (DE) 1981-09-01 US disclosed
US-4190602-A PHOTOCHEMICAL SENSITIZERS BY REACTION OF SULFUROUS ACID ESTER OR THIONYL CHLORIDE AND A PRIMARY ALCOHOL CIBA-GEIGY CORPORATION (US) 1980-02-26 US disclosed
US-4144156-A Manufacture of unsymmetric monoacetals of aromatic 1,2-diketones employable as photoiniatiators BASF AKTIENGESELLSCHAFT (DE) 1979-03-13 US disclosed