SCHEMBL9013385

SCHEMBL9013385

Fc1ccc(C(c2ccc(F)cc2)N2CCN(CCOc3cc(C(F)(F)F)nc(-c4ccccc4)n3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
ACHE P22303 3/20 0.45
TDP1 Q9NUW8 1/20 0.43

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
SCHEMBL9013334 0.96 KMT2A (0.49) MEN1KMT2AACHETDP1
SCHEMBL9013689 0.95 ACHE (0.47) MEN1KMT2AACHETDP1
SCHEMBL9013654 0.94 KMT2A (0.50) MEN1KMT2ATDP1
SCHEMBL9013570 0.91 ACHE (0.44) MEN1KMT2AACHE
SCHEMBL9013419 0.89 ESR1 (0.45) MEN1KMT2AACHE
SCHEMBL9013760 0.89 CYP2D6 (0.48) MEN1KMT2ATDP1
SCHEMBL9013766 0.87 MEN1 (0.47) MEN1KMT2A
SCHEMBL9013352 0.86 MEN1 (0.52) MEN1KMT2ATDP1
SCHEMBL9013741 0.83 MEN1 (0.50) MEN1KMT2ATDP1
SCHEMBL9013561 0.82 ACHE (0.44) ACHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5589477-A LEARNING ENHANCEMENT, CNS NIPPON SHINYAKU COMPANY, LIMITED (JP) 1996-12-31 US disclosed
EP-0555478-A1 PYRIMIDINE DERIVATIVE AND MEDICINE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-08-18 EP disclosed