SCHEMBL10562102

SCHEMBL10562102

CCCCCCCCc1cnc(-c2ccc(-c3ccc(CCCCCCC)cc3F)cc2)nc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RARB P10826 9/20 0.58
▸ RAB9A P51151 4/20 0.57
▸ MAPT P10636 4/20 0.57
▸ SMN1; SMN2 Q16637 3/20 0.57
▸ MEN1 O00255 2/20 0.57
▸ ALDH1A1 P00352 2/20 0.57
▸ KMT2A Q03164 2/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ USP2 O75604 1/20 0.57
▸ GAA P10253 1/20 0.57
▸ HPGD P15428 1/20 0.57
▸ HSD17B10 Q99714 1/20 0.57
▸ NPC1 O15118 2/20 0.45
▸ STAT3 P40763 1/20 0.45
▸ ATM Q13315 1/20 0.45
▸ RARA P10276 2/20 0.43
▸ RARG P13631 1/20 0.43
▸ NFKB1 P19838 1/20 0.42
▸ NFKB2 Q00653 1/20 0.42
▸ RELA Q04206 1/20 0.42

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
SCHEMBL10559048 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10555159 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10558093 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10554809 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10556001 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10554236 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10562299 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10557032 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10558896 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1
SCHEMBL10555021 1.00 RARB (0.58) RARBRAB9AMAPTSMN1; SMN2MEN1

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-4812258-A LIQUID CRYSTAL DIELECTRICS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-03-14 — — US disclosed
EP-0126949-A2 Fluorine-containing pyrimidine derivatives MERCK PATENT GmbH (DE) 1984-12-05 — — EP disclosed
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