SCHEMBL6132477

SCHEMBL6132477

CC1CN(c2ccc(-c3ccc(O)cc3)cc2)CC(C)O1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.55
▸ RAB9A P51151 1/20 0.43
▸ TSHR P16473 2/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 1/20 0.40
▸ PKM P14618 1/20 0.40
▸ ESR1 P03372 1/20 0.39
▸ ESR2 Q92731 1/20 0.39
▸ CYP1A2 P05177 1/20 0.39
▸ CYP3A4 P08684 1/20 0.39
▸ CYP2C9 P11712 1/20 0.39
▸ CYP2C19 P33261 1/20 0.39
▸ KMT2A Q03164 3/20 0.39
▸ MTOR P42345 1/20 0.39
▸ GAA P10253 2/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ WNT3A P56704 1/20 0.38
▸ LMNA P02545 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38

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
SCHEMBL6132474 1.00 MAPT (0.55) MAPTRAB9ATSHRSMN1; SMN2ALDH1A1
SCHEMBL327800 0.77 MAPT (0.57) MAPTRAB9ATSHRALDH1A1KDM4E
SCHEMBL18436831 0.77 MAPT (0.57) MAPTRAB9ATSHRALDH1A1KDM4E
SCHEMBL24352865 0.77 MAPT (0.57) MAPTRAB9ATSHRALDH1A1KDM4E
SCHEMBL7790503 0.77 MAPT (0.57) MAPTRAB9ATSHRALDH1A1KDM4E
SCHEMBL23731989 0.77 MAPT (0.57) MAPTRAB9ATSHRALDH1A1KDM4E
SCHEMBL6132323 0.77 USP2 (0.57) MAPTTSHRSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6132666 0.77 USP2 (0.57) MAPTTSHRSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6132668 0.77 USP2 (0.57) MAPTTSHRSMN1; SMN2ALDH1A1KDM4E
SCHEMBL6132320 0.77 USP2 (0.57) MAPTTSHRSMN1; SMN2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6884868-B1 Cyclic hexapeptides having antibiotic activity FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2005-04-26 — — US disclosed
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