SCHEMBL11535690

SCHEMBL11535690

CSc1ccc(C(c2ccccc2)(n2cncn2)C(C)(C)C)cc1

nearest known ligand 0.40

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 7/20 0.40
LMNA P02545 1/20 0.36
HSP90AA1 P07900 2/20 0.35
KIF11 P52732 1/20 0.33
FGFR1 P11362 1/20 0.31
MAPT P10636 1/20 0.30
EDNRB P24530 1/20 0.30
EDNRA P25101 1/20 0.30

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
SCHEMBL11536568 0.88 LMNA (0.44) CYP19A1LMNAHSP90AA1MAPT
SCHEMBL11536149 0.86 CYP19A1 (0.55) CYP19A1LMNAHSP90AA1KIF11FGFR1
SCHEMBL11534485 0.84 CYP19A1 (0.42) CYP19A1LMNAHSP90AA1KIF11MAPT
SCHEMBL11536335 0.83 CYP19A1 (0.44) CYP19A1LMNAHSP90AA1
SCHEMBL11538629 0.83 TSHR (0.41) CYP19A1LMNAHSP90AA1
SCHEMBL11534916 0.81 KMT2A (0.43) CYP19A1LMNAHSP90AA1KIF11MAPT
SCHEMBL11534087 0.81 CYP19A1 (0.43) CYP19A1LMNAHSP90AA1KIF11MAPT
SCHEMBL11534015 0.81 CYP19A1 (0.42) CYP19A1LMNAHSP90AA1MAPT
SCHEMBL11531721 0.80 CYP19A1 (0.66) CYP19A1LMNAHSP90AA1KIF11
SCHEMBL11536263 0.80 TSHR (0.39) CYP19A1LMNAHSP90AA1

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-4140782-A Combating fungi and nematodes with diphenyl-triazolyl-methanes BAYER AKTIENGESELLSCHAFT (DE) 1979-02-20 US disclosed