SCHEMBL10418596

SCHEMBL10418596

NC1=NN(c2ccccc2)C(c2cccnc2)C1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.50
NPEPPS P55786 1/20 0.50
MAPK1 P28482 1/20 0.50
HTT P42858 1/20 0.50
CHRNA7 P36544 5/20 0.46
CHRNB2 P17787 4/20 0.46
CHRNA4 P43681 4/20 0.46
ALDH1A1 P00352 4/20 0.46
CHRNB4 P30926 2/20 0.46
CHRNA3 P32297 2/20 0.46
CHRNA2 Q15822 2/20 0.46
LMNA P02545 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTR3E A5X5Y0 1/20 0.46
PSIP1 O75475 1/20 0.46
TRPA1 O75762 1/20 0.46
HTR3B O95264 1/20 0.46
CHRNA1 P02708 1/20 0.46
CHRNG P07510 1/20 0.46
CHRNB1 P11230 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
SCHEMBL11068412 0.86 MEN1 (0.54) MAPTMAPK1HTTALDH1A1LMNA
SCHEMBL908010 0.79 GAA (0.46) MAPTMAPK1ALDH1A1LMNATDP1
SCHEMBL11064115 0.76 MEN1 (0.58) MAPTMAPK1HTTALDH1A1LMNA
SCHEMBL908494 0.76 CA1 (0.56) MAPTALDH1A1LMNAMEN1KMT2A
SCHEMBL11060055 0.76 EGFR (0.53) MAPTMAPK1HTTALDH1A1LMNA
SCHEMBL11060811 0.76 PRKCZ (0.56) MEN1KMT2AATM
SCHEMBL10374292 0.73 MAPT (0.43) MAPTNPEPPSMAPK1HTTALDH1A1
SCHEMBL11102158 0.72 L3MBTL1 (0.69) MEN1KMT2A
SCHEMBL8637990 0.72 PRKCZ (0.46) MAPTMAPK1HTTALDH1A1LMNA
SCHEMBL11104257 0.72 EGFR (0.57) ATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0178035-B1 ANTI-INFLAMMATORY 1,N-DIARYLPYRAZOL-3-AMINES, COMPOSITIONS CONTAINING THEM AND PROCESSES FOR THEIR PREPARATION FISONS plc (GB) 1990-01-03 EP disclosed
US-4810719-A Anti-inflammator 1,n-diarylpyrazol-3-amines FISONS PLC (GB) 1989-03-07 US disclosed
CN-85103468-A Prepare the method for new compound and new purposes thereof 1986-09-10 CN disclosed