SCHEMBL11769792

SCHEMBL11769792

CCNC(=O)Nc1cc(C)c(Sc2cc(OC)ccc2OC)c(C)c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTNR1B P49286 1/20 0.50
▸ MEN1 O00255 7/20 0.45
▸ KMT2A Q03164 7/20 0.45
▸ HTT P42858 2/20 0.45
▸ POLB P06746 2/20 0.44
▸ MAPT P10636 6/20 0.42
▸ HSD17B10 Q99714 2/20 0.42
▸ PKM P14618 1/20 0.42
▸ MAPK1 P28482 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ GAA P10253 2/20 0.41
▸ TP53 P04637 2/20 0.41
▸ DHFR P00374 1/20 0.41
▸ TYMS P04818 1/20 0.41
▸ ABL1 P00519 1/20 0.40
▸ RAB9A P51151 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.40
▸ LMNA P02545 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ KDM4E B2RXH2 1/20 0.40

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
SCHEMBL11768444 0.88 MTNR1B (0.49) MTNR1BMEN1KMT2AHTTPOLB
SCHEMBL11768383 0.88 LMNA (0.48) MEN1KMT2AHTTPOLBMAPT
SCHEMBL11767054 0.87 MAPT (0.44) MEN1KMT2AHTTPOLBMAPT
SCHEMBL11770943 0.75 TSHR (0.46) POLBMAPTTSHRGAATP53
SCHEMBL11772235 0.74 MAPT (0.47) MEN1KMT2AHTTPOLBMAPT
SCHEMBL9435964 0.71 RAB9A (0.72) MTNR1BMEN1KMT2APOLBMAPT
SCHEMBL15840093 0.71 MAPK1 (0.58) MTNR1BMEN1KMT2AHTTMAPT
SCHEMBL5786396 0.71 MTNR1B (0.67) MTNR1BMEN1KMT2AHTTPOLB
SCHEMBL10073226 0.69 MAPT (0.44) MTNR1BMEN1KMT2AHTTPOLB
SCHEMBL13480581 0.69 MTNR1B (0.72) MTNR1BMEN1KMT2AHTTMAPT

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-3970752-A Coccidiocidal compositions utilizing 1-phenyl-substituted 1,3,5-triazine BAYER AKTIENGESELLSCHAFT (DT) 1976-07-20 — — US disclosed
US-3948893-A COCCIDIOSIS BAYER AKTIENGESELLSCHAFT (DT) 1976-04-06 — — US disclosed
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