SCHEMBL13585027

SCHEMBL13585027

O=C1Nc2ccc(Br)cc2C(c2ccccn2)=NC1O

nearest known ligand 0.66

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ ADRA1A P35348 1/20 0.61
▸ GABRA1 P14867 3/20 0.51
▸ GABRA5 P31644 3/20 0.51
▸ GABRA3 P34903 3/20 0.51
▸ GABRA2 P47869 3/20 0.51
▸ GABRB2 P47870 3/20 0.51
▸ KMT2A Q03164 3/20 0.51
▸ LMNA P02545 2/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ ALB P02768 1/20 0.51
▸ PGR P06401 1/20 0.50
▸ MAPK1 P28482 1/20 0.45
▸ MAPT P10636 1/20 0.44
▸ CHRM1 P11229 1/20 0.43
▸ TP53 P04637 1/20 0.41
▸ POLB P06746 1/20 0.41

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
SCHEMBL7722823 0.86 GABRA1 (0.70) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL3142613 0.86 GABRA1 (0.70) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL11464920 0.86 ADRA1A (0.61) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL21272249 0.83 CHRM1 (0.58) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL21272128 0.83 CHRM1 (0.58) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL11391896 0.83 KMT2A (0.73) GABRA1GABRA5GABRA3GABRA2GABRB2
SCHEMBL28926377 0.81 ADRA1A (0.53) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL20473304 0.81 ADRA1A (0.53) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL28926380 0.81 ADRA1A (0.53) ADRA1AGABRA1GABRA5GABRA3GABRA2
SCHEMBL11389506 0.81 GABRA1 (0.61) GABRA1GABRA5GABRA3GABRA2GABRB2

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
US-9273012-B2 Facile preparation of 4-substituted quinazolines and related heterocycles UNIVERSITY OF HOUSTON SYSTEM (US) 2016-03-01 — — US disclosed
US-20120283436-A1 FACILE PREPARATION OF 4-SUBSTITUTED QUINAZOLINES AND RELATED HETEROCYCLES THE UNIVERSITY OF HOUSTON (US) 2012-11-08 — — US disclosed
WO-2012151141-A2 A FACILE PREPARATION OF 4-SUBSTITUTED QUINAZOLINES AND RELATED HETEROCYCLES UNIVERSITY OF HOUSTON SYSTEM (US) 2012-11-08 — — WO disclosed
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