SCHEMBL11280071

SCHEMBL11280071

Cc1cc(C)c2c(N)[nH]nc2n1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 7/20 0.51
ALDH1A1 P00352 7/20 0.51
HSP90AA1 P07900 4/20 0.51
CYP1A2 P05177 4/20 0.51
CYP2D6 P10635 3/20 0.51
CYP2C19 P33261 2/20 0.51
GAA P10253 6/20 0.50
KMT2A Q03164 3/20 0.50
LMNA P02545 5/20 0.48
CYP2C9 P11712 1/20 0.48
POLB P06746 4/20 0.45
RAB9A P51151 2/20 0.45
CYP3A4 P08684 1/20 0.45
BRD4 O60885 1/20 0.43
KDM4E B2RXH2 4/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
HPGD P15428 3/20 0.42
MITF O75030 2/20 0.42
HTT P42858 2/20 0.42
RAD52 P43351 2/20 0.42

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
SCHEMBL27763982 0.79 GAA (0.41) MAPTALDH1A1CYP1A2GAAKMT2A
SCHEMBL4857909 0.69 SMN1; SMN2 (0.55) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6
SCHEMBL11273549 0.67 GAA (1.00) MAPTALDH1A1CYP1A2CYP2C19GAA
SCHEMBL14520700 0.67 KDM4E (0.58) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6
SCHEMBL2481449 0.65 ALDH1A1 (0.41) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6
SCHEMBL31350638 0.64 KDM4E (0.45) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6
SCHEMBL31350484 0.64 KDM4E (0.45) MAPTALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL31350740 0.64 KDM4E (0.49) MAPTALDH1A1CYP1A2CYP2D6CYP2C19
SCHEMBL24348510 0.64 SMN1; SMN2 (0.58) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6
SCHEMBL2305957 0.63 ALDH1A1 (0.38) MAPTALDH1A1HSP90AA1CYP1A2CYP2D6

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
US-4366231-A Photographic material containing a stabilizer, a process for its production, a development process, new pyrazoles, a process for their production and intermediate products AGFA GEVAERT AKTIENGESELLSCHAFT (DE) 1982-12-28 US disclosed