SCHEMBL3670118

SCHEMBL3670118

CCc1c(N)c(N)c2ccccc2c1Cl

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.37
MAPT P10636 3/20 0.34
HSD17B10 Q99714 3/20 0.34
ALDH1A1 P00352 3/20 0.34
CYP1A2 P05177 3/20 0.34
LMNA P02545 3/20 0.34
CYP2D6 P10635 2/20 0.34
CYP2C9 P11712 2/20 0.34
CYP2C19 P33261 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
GMNN O75496 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
ELANE P08246 1/20 0.34
CTSG P08311 1/20 0.34
CTSA P10619 1/20 0.34
ALOX15 P16050 1/20 0.34
NFKB1 P19838 1/20 0.34
THPO P40225 1/20 0.34
MTOR P42345 1/20 0.34

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
SCHEMBL3670998 0.81 ACHE (0.35) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL4645814 0.76 MAOA (0.41) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL5751135 0.76 ACHE (0.43) KDM4EMAPTHSD17B10ALDH1A1LMNA
SCHEMBL3670402 0.76 GABRA1 (0.35) KDM4EMAPTHSD17B10ALDH1A1SMN1; SMN2
SCHEMBL3668885 0.76 KDM4E (0.33) KDM4EMAPTHSD17B10ALDH1A1LMNA
SCHEMBL15213457 0.74 ACHE (0.37) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL31238921 0.73 CYP1A2 (0.39) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL11476797 0.73 CYP1A2 (0.39) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL3673588 0.72 ALDH1A1 (0.37) KDM4EMAPTHSD17B10ALDH1A1CYP1A2
SCHEMBL11765896 0.72 ACHE (0.35) KDM4EMAPTHSD17B10ALDH1A1CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1426392-B1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL CO (JP) 2010-02-24 EP disclosed
US-6960640-B2 Composition for optical material MITSUBISHI GAS CHEMICAL CO., LTD. (JP) 2005-11-01 US disclosed
US-20040147708-A1 Composition for optical material MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-07-29 US disclosed
EP-1426392-A1 COMPOSITION FOR OPTICAL MATERIAL MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2004-06-09 EP disclosed