SCHEMBL25533196

SCHEMBL25533196

CNc1cc(C(C)(c2ccc(N)c(CN)c2)C(F)(F)F)ccc1N

nearest known ligand 0.36

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ TSHR P16473 1/20 0.36
▸ MAPK1 P28482 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ HSD17B10 Q99714 1/20 0.36
▸ AOC1 P19801 2/20 0.33
▸ AOC3 Q16853 2/20 0.33
▸ HSD17B2 P37059 1/20 0.31
▸ LMNA P02545 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
SCHEMBL25533195 0.81 MEN1 (0.39) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL14934059 0.74 MEN1 (0.41) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL118960 0.73 ALDH1A1 (0.46) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL30167000 0.73 ALDH1A1 (0.46) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL28173105 0.73 HSD11B1 (0.39) —
SCHEMBL23455648 0.71 ALDH1A1 (0.48) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL3556000 0.71 IDO1 (0.44) MEN1TSHRMAPK1KMT2AHSD17B10
SCHEMBL25533221 0.69 ALDH1A1 (0.41) MEN1ALOX15TSHRKMT2AHSD17B10
SCHEMBL27817083 0.69 SMN1; SMN2 (0.42) MEN1ALOX15TSHRMAPK1KMT2A
SCHEMBL26417533 0.68 MEN1 (0.37) MEN1ALOX15TSHRMAPK1KMT2A

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-11655339-B2 Polybenzimidazole, precursor polyamide thereof, and method for producing same DAIKIN INDUSTRIES, LTD. (JP) 2023-05-23 — — US disclosed
US-20230128992-A1 POLYBENZIMIDAZOLE, PRECURSOR POLYAMIDE THEREOF, AND METHOD FOR PRODUCING SAME DAIKIN INDUSTRIES, LTD. (JP) 2023-04-27 — — US disclosed
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