SCHEMBL7519169

SCHEMBL7519169

O=C(Cl)N1C(c2ccccc2)=C1c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
P2RX4 Q99571 1/20 0.45
PTPN1 P18031 1/20 0.38
GSK3B P49841 1/20 0.38
MAPT P10636 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 4/20 0.36
LMNA P02545 2/20 0.35
TSHR P16473 2/20 0.35
ABCC4 O15439 1/20 0.35
GAA P10253 1/20 0.35
PTGS1 P23219 1/20 0.35
HTT P42858 1/20 0.35
NR1H2 P55055 1/20 0.35
NR1H3 Q13133 1/20 0.35
POLB P06746 1/20 0.35
DAO P14920 1/20 0.35
NAPRT Q6XQN6 1/20 0.35
ALOX15 P16050 1/20 0.35
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35

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
SCHEMBL4742835 0.76 LMNA (0.47) P2RX4MAPTSMN1; SMN2ALDH1A1LMNA
SCHEMBL1966470 0.76 SMN1; SMN2 (0.46) MAPTSMN1; SMN2ALDH1A1LMNAGAA
Biphenyl SCHEMBL7062651 0.73 ALDH1A1 (0.60) PTPN1GSK3BMAPTSMN1; SMN2ALDH1A1
Biphenyl SCHEMBL3399859 0.73 ALDH1A1 (0.60) PTPN1GSK3BMAPTSMN1; SMN2ALDH1A1
Biphenyl SCHEMBL5071211 0.73 ALDH1A1 (0.60) PTPN1GSK3BMAPTSMN1; SMN2ALDH1A1
Biphenyl SCHEMBL27755857 0.69 ALDH1A1 (0.75) MAPTSMN1; SMN2ALDH1A1NPC1RAB9A
Biphenyl SCHEMBL310004 0.69 ALDH1A1 (0.53) MAPTSMN1; SMN2ALDH1A1LMNATSHR
Biphenyl SCHEMBL27930698 0.69 ALDH1A1 (0.53) PTPN1GSK3BMAPTSMN1; SMN2ALDH1A1
Biphenyl SCHEMBL2901532 0.69 SMN1; SMN2 (0.61) MAPTSMN1; SMN2ALDH1A1LMNATSHR
SCHEMBL9592299 0.67 CA12 (0.47) P2RX4MAPTALDH1A1LMNAPOLB

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-0698602-B1 Process for the preparation of 5-chlorocarbonyl-5H-dibenz(b,f)azepine AWD PHARMA GMBH & CO KG (DE) 2002-02-06 EP disclosed
EP-0698602-A1 Process for the preparation of 5-chlorocarbonyl-5H-dibenz(b,f)azepine ARZNEIMITTELWERK DRESDEN GMBH (DE) 1996-02-28 EP disclosed
US-5185443-A Method for preparing 5-carbamoyl-5H-dibenz[b,f]azepine ARZNEIMITTELWERK DRESDEN GMBH (DE) 1993-02-09 US disclosed
US-5110923-A METHOD FOR PREPARING 5-CHLOROCARBONYL-5H-DIBENZ(B,F)AZEPINE ARZNEIMITTELWERK DRESDEN GMBH (DE) 1992-05-05 US disclosed
EP-0466972-A1 Process for the preparation of 5-chlorocarbonyl-5H-dibenzo-[b,f]azepine ARZNEIMITTELWERK DRESDEN GmbH (DE) 1992-01-22 EP disclosed