SCHEMBL7833897

SCHEMBL7833897

CCC(=O)c1ccccc1Nc1ccccc1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.62
ALOX15 P16050 1/20 0.62
FABP4 P15090 1/20 0.61
GAA P10253 1/20 0.54
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
NPC1 O15118 1/20 0.53
ALDH1A1 P00352 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
SIRT2 Q8IXJ6 7/20 0.50
MT-CO2 P00403 2/20 0.50
CLCN2 P51788 1/20 0.49
AKR1C3 P42330 2/20 0.47
AKR1C2 P52895 2/20 0.47
PTGS1 P23219 1/20 0.47
YAP1 P46937 1/20 0.47
TEAD4 Q15561 1/20 0.47
TEAD2 Q15562 1/20 0.47
SIRT1 Q96EB6 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
SCHEMBL29050682 0.88 NPC1 (0.51) MAPTALOX15FABP4GAAMEN1
SCHEMBL27727061 0.87 MAPT (0.47) MAPTALOX15FABP4GAAMEN1
SCHEMBL12112435 0.86 MAPT (0.58) MAPTALOX15FABP4MEN1KMT2A
Fenamic Acid SCHEMBL28097929 0.84 FABP4 (0.79) MAPTALOX15FABP4MEN1KMT2A
SCHEMBL7835113 0.82 YAP1 (0.65) MAPTALOX15FABP4GAAMEN1
SCHEMBL12983141 0.81 MEN1 (0.55) MAPTGAAMEN1KMT2ANPC1
SCHEMBL14575409 0.81 AKR1C3 (0.47) MAPTALOX15FABP4GAAMEN1
SCHEMBL14853341 0.80 YAP1 (0.77) MAPTGAAALDH1A1RAB9ASMN1; SMN2
SCHEMBL7959032 0.79 ALDH1A1 (0.45) MAPTGAAKMT2ANPC1ALDH1A1
SCHEMBL605325 0.79 KDM4E (0.58) MAPTFABP4GAAKMT2ANPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0783505-B1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 2001-03-07 EP disclosed
CN-1046731-C Pyrrolo [2,3-d ] pyrimidines and their use NOVARTIS AG (CH) 1999-11-24 CN disclosed
US-5869485-A Pyrrolo 2,3-d!pyrimidines and their use NOVARTIS FINANCE CORP. (US) 1999-02-09 US disclosed
CN-1164234-A Pyrrolo [2, 3-d ] pyrimidines and their use NOVARTIS AG (CH) 1997-11-05 CN disclosed
EP-0783505-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE Novartis AG (CH) 1997-07-16 EP disclosed
WO-1996010028-A1 PYRROLO[2,3-d]PYRIMIDINES AND THEIR USE NOVARTIS AG (CH) 1996-04-04 WO disclosed