SCHEMBL10967972

SCHEMBL10967972

CCOC(=O)C(=CNc1ncnc2ccccc12)C(=O)OCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 4/20 0.59
KMT2A Q03164 4/20 0.59
NPC1 O15118 2/20 0.59
CASP3 P42574 2/20 0.59
SENP8 Q96LD8 2/20 0.59
SENP7 Q9BQF6 2/20 0.59
SENP6 Q9GZR1 2/20 0.59
MAPT P10636 4/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2D6 P10635 2/20 0.58
MAPK1 P28482 2/20 0.58
CYP1A2 P05177 1/20 0.58
CYP2C19 P33261 1/20 0.58
GAA P10253 2/20 0.55
MEN1 O00255 2/20 0.55
DHODH Q02127 4/20 0.53
LMNA P02545 2/20 0.52
POLB P06746 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ALDH1A1 P00352 1/20 0.51

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
SCHEMBL10966662 0.85 KMT2A (0.55) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10969276 0.85 KDM4E (0.57) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10967652 0.84 EGFR (0.53) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10971593 0.83 EGFR (0.52) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10970783 0.83 CYP1A2 (0.51) KMT2AMAPTCYP3A4CYP2D6MAPK1
SCHEMBL10967697 0.83 MAPT (0.62) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10971806 0.82 MAPT (0.55) KMT2AMAPTCYP3A4CYP2D6MAPK1
SCHEMBL10967368 0.82 KDM4E (0.53) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10970750 0.82 EGFR (0.51) RAB9AKMT2ANPC1CASP3SENP8
SCHEMBL10972874 0.82 CYP1A2 (0.49) RAB9AKMT2ANPC1CASP3SENP8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4543356-A Quinazoline derivatives FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1985-09-24 US disclosed
EP-0030156-B1 QUINAZOLINE DERIVATIVES, PROCESSES FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-03-21 EP disclosed
US-4429126-A ANTIASTHMA FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1984-01-31 US disclosed
EP-0030156-A1 Quinazoline derivatives, processes for their preparation and pharmaceutical compositions containing them FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1981-06-10 EP disclosed