SCHEMBL11418709

SCHEMBL11418709

Cc1cc2c(cnc(=O)n2C(C)C)cc1N

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ATAD2 Q6PL18 1/20 0.40
▸ ADORA3 P0DMS8 2/20 0.35
▸ NR1I2 O75469 1/20 0.35
▸ EGFR P00533 1/20 0.35
▸ ADRA2A P08913 1/20 0.35
▸ TBXA2R P21731 1/20 0.35
▸ PTGS2 P35354 1/20 0.35
▸ OPRD1 P41143 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ SMN1; SMN2 Q16637 1/20 0.34
▸ UHRF1 Q96T88 1/20 0.33
▸ PIK3CA P42336 4/20 0.33
▸ TERT O14746 1/20 0.33
▸ BTK Q06187 1/20 0.32
▸ ADORA2A P29274 1/20 0.31
▸ ADORA2B P29275 1/20 0.31
▸ ADORA1 P30542 1/20 0.31
▸ MTOR P42345 3/20 0.31
▸ CSNK1E P49674 1/20 0.31
▸ CLK1 P49759 1/20 0.31

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
SCHEMBL17807791 0.72 CASR (0.45) CASR
SCHEMBL7688681 0.69 POLB (0.42) ADORA3NR1I2EGFRADRA2ATBXA2R
SCHEMBL22419361 0.69 CASR (0.44) ADORA3NR1I2EGFRADRA2ATBXA2R
SCHEMBL23531670 0.65 ATAD2 (0.44) ATAD2UHRF1TERTCYP3A4TSHR
SCHEMBL29824722 0.65 ATAD2 (0.44) ATAD2UHRF1TERTCYP3A4TSHR
SCHEMBL31716785 0.65 TERT (0.40) ATAD2SMN1; SMN2UHRF1TERTCLK4
SCHEMBL16477322 0.63 ALDH1A1 (0.32) SMN1; SMN2ADORA2B
SCHEMBL31716739 0.62 ATAD2 (0.42) ATAD2CYP3A4TSHRMAPK1
SCHEMBL17807776 0.62 CASR (0.36) CASR
SCHEMBL27229130 0.61 BTK (0.37) BTK

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-4224328-A Methods with 1-substituted-4-aryl-quinazolin-2(1H)-ones and thiones and pyrido[2,3-d]pyrimidin-2-ones as platelet aggregation inhibitors SANDOZ, INC. (US) 1980-09-23 — — US disclosed
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