SCHEMBL9255098

SCHEMBL9255098

Clc1ccc(-c2nn(CCn3ccnc3)c3ccncc23)cc1Cl

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.41
LMNA P02545 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
MEN1 O00255 1/20 0.41
HTT P42858 1/20 0.41
KMT2A Q03164 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
JAK2 O60674 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
ALOX15 P16050 2/20 0.38
HSD17B10 Q99714 2/20 0.38
WDR5 P61964 4/20 0.37
SCN1A P35498 1/20 0.35
SCN4A P35499 1/20 0.35
SCN5A Q14524 1/20 0.35
SCN9A Q15858 1/20 0.35
SCN2A Q99250 1/20 0.35
SCN3A Q9NY46 1/20 0.35
SCN8A Q9UQD0 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
SCHEMBL9259487 0.89 TP53 (0.44) MAPK1SCN1ASCN4ASCN5ASCN9A
SCHEMBL9257071 0.83 CYP11B1 (0.47) HSD17B10SCN1ASCN4ASCN5ASCN9A
SCHEMBL9303594 0.82 HRH1 (0.36) ALOX15HSD17B10ALDH1A1KDM4E
SCHEMBL9303543 0.81 TEAD2 (0.39) MAPK1ALOX15HSD17B10ALDH1A1KDM4E
SCHEMBL9257046 0.80 KCNH2 (0.38) LMNAMEN1KMT2AL3MBTL1WDR5
SCHEMBL9304621 0.80 TEAD2 (0.43) ALOX15HSD17B10ALDH1A1KDM4E
SCHEMBL9255091 0.75 NAMPT (0.33)
Maleic Acid SCHEMBL8135697 0.74 TEAD2 (0.37) HSD17B10KDM4E
Fumaric Acid SCHEMBL8135703 0.74 TEAD2 (0.37) HSD17B10KDM4E
Fumaric Acid SCHEMBL8138733 0.73 TEAD2 (0.40) HSD17B10KDM4E

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
US-5428169-A Antidepressants, treating compulsive disorders, stuttering, trichotillomania HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1995-06-27 US disclosed
US-5380847-A Reaction of 1-methylpiperidine-4-hydrazine, ketone and titanium isopropoxide to form hydrazone HOECHST-ROUSSEL PHARMACEUTICALS, INC. (US) 1995-01-10 US disclosed
EP-0594001-A1 Pyrazolo 4,3-c pyridines, a process for their preparation and their use as serotonin reuptake inhibitors HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1994-04-27 EP disclosed
US-5296491-A Pyrazolo[4,3-c]pyridines and their use as serotonin reuptake inhibitors HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1994-03-22 US disclosed
US-5264576-A Antiserotonin agents, antidepressants and obsessive-compulsive disorders HOECHST-ROUSSEL PHARMACEUTICALS INCORPORATED (US) 1993-11-23 US disclosed