SCHEMBL11274181

SCHEMBL11274181

COC(=O)Nn1cnc2cc(SCCN3CCOCC3)ccc21

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ FGFR1 P11362 4/20 0.52
▸ HPGD P15428 2/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ MAPK1 P28482 1/20 0.41
▸ SRC P12931 3/20 0.40
▸ THRB P10828 1/20 0.39
▸ KDM4E B2RXH2 5/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ DCTPP1 Q9H773 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ RAB9A P51151 1/20 0.37
▸ TP53 P04637 1/20 0.37

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
SCHEMBL11866574 0.71 MAPK14 (0.38) FGFR1HPGDMEN1KMT2AALDH1A1
SCHEMBL11866098 0.70 CYP1A2 (0.37) FGFR1MEN1KMT2AALDH1A1KDM4E
SCHEMBL11864936 0.70 GCK (0.41) HPGDMEN1KMT2AALDH1A1THRB
SCHEMBL9279585 0.69 KDM4E (0.44) HPGDMEN1KMT2AALDH1A1THRB
SCHEMBL11866856 0.68 FBP1 (0.36) FGFR1ALDH1A1KDM4EHSD17B10POLB
SCHEMBL11868560 0.68 GCK (0.40) FGFR1MEN1KMT2AALDH1A1KDM4E
SCHEMBL11870218 0.67 ALDH1A1 (0.34) FGFR1MEN1KMT2AALDH1A1HSD17B10
SCHEMBL11396941 0.65 THRB (0.48) ALDH1A1THRBKDM4EHSD17B10POLB
SCHEMBL11529719 0.65 POLB (0.78) KMT2AMAPK1KDM4EPOLBRAB9A
SCHEMBL11478965 0.65 POLB (0.56) MEN1KMT2AALDH1A1KDM4EHSD17B10

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-4353913-A ANTHELMINTICS BAYER AKTIENGESELLSCHAFT (DE) 1982-10-12 — — US disclosed
US-4287199-A USEFUL AS ANTHELMINITICS BAYER AKTIENGESELLSCHAFT (DE) 1981-09-01 — — US disclosed
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