Aniline

Aniline

SCHEMBL28041584

Nc1ccccc1.c1ccc(-n2cnnn2)cc1

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 6/20 0.81
MAPT P10636 2/20 0.53
F2 P00734 1/20 0.53
KMT2A Q03164 3/20 0.50
KCNJ1 P48048 2/20 0.50
RAB9A P51151 1/20 0.50
SMN1; SMN2 Q16637 2/20 0.49
LMNA P02545 2/20 0.49
ALDH1A1 P00352 3/20 0.49
HTT P42858 1/20 0.49
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 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
SCHEMBL342739 0.90 NOTUM (1.00) NOTUMMAPTF2KMT2AKCNJ1
SCHEMBL28994295 0.88 NOTUM (0.95) NOTUMMAPTF2KMT2AKCNJ1
SCHEMBL3962509 0.88 NOTUM (0.95) NOTUMMAPTF2KMT2AKCNJ1
Hydrochloric Acid SCHEMBL2897369 0.88 NOTUM (0.95) NOTUMMAPTF2KMT2AKCNJ1
SCHEMBL7096356 0.88 NOTUM (0.95) NOTUMMAPTF2KMT2AKCNJ1
Bromide SCHEMBL3939883 0.88 NOTUM (0.95) NOTUMMAPTF2KMT2AKCNJ1
SCHEMBL1163779 0.86 NOTUM (0.64) NOTUMMAPTF2KMT2AKCNJ1
SCHEMBL1353899 0.83 NOTUM (0.60) NOTUMMAPTF2KMT2ASMN1; SMN2
SCHEMBL987888 0.82 NOTUM (0.84) NOTUMMAPTF2KMT2AKCNJ1
Thiophene SCHEMBL5329358 0.79 NOTUM (0.78) NOTUMMAPTF2KMT2AKCNJ1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104086485-B Prepare the method for poly-substituted quinoline type aromatic ring pyridine derivate TSINGHUA UNIVERSITY (CN) 2016-03-30 CN disclosed