SCHEMBL29645848

SCHEMBL29645848

CC[C@H](Nc1nc2ccccc2c2nc(-c3ccc(Br)cc3OC(F)F)nn12)C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.40
GAA P10253 4/20 0.40
ALPL P05186 2/20 0.40
KMT2A Q03164 2/20 0.40
ALPI P09923 1/20 0.40
ALPG P10696 1/20 0.40
MAPT P10636 8/20 0.39
POLB P06746 3/20 0.39
TP53 P04637 5/20 0.39
HTT P42858 2/20 0.39
HCRTR1 O43613 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
THRB P10828 2/20 0.37
ADORA3 P0DMS8 1/20 0.36
PTGFR P43088 3/20 0.36

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
SCHEMBL29645710 1.00 LMNA (0.40) LMNAGAAALPLKMT2AALPI
SCHEMBL22981252 1.00 LMNA (0.40) LMNAGAAALPLKMT2AALPI
SCHEMBL22979832 1.00 LMNA (0.40) LMNAGAAALPLKMT2AALPI
SCHEMBL22979834 1.00 LMNA (0.40) LMNAGAAALPLKMT2AALPI
SCHEMBL29645432 0.90 TP53 (0.42) LMNAGAAALPLKMT2AALPI
SCHEMBL29646172 0.90 TP53 (0.42) LMNAGAAALPLKMT2AALPI
SCHEMBL22979291 0.90 TP53 (0.42) LMNAGAAALPLKMT2AALPI
SCHEMBL22979288 0.90 TP53 (0.42) LMNAGAAALPLKMT2AALPI
SCHEMBL22981120 0.90 TP53 (0.42) LMNAGAAALPLKMT2AALPI
SCHEMBL22981167 0.90 MAPT (0.43) LMNAGAAALPLKMT2AALPI

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
CN-114466850-B [1,2,4] Triazolo [1,5-C ] quinazolin-5-amine 拜耳股份有限公司 2024-09-10 CN claimed
EP-4013508-A1 [1,2,4]TRIAZOLO[1,5-C]QUINAZOLIN-5-AMINES Bayer Aktiengesellschaft (DE) 2022-06-22 EP claimed
CN-114466850-A [1,2,4] triazolo [1,5-C ] quinazolin-5-amines 拜耳股份有限公司 2022-05-10 CN claimed