SCHEMBL10257496

SCHEMBL10257496

COCC(=O)NC(C)COc1cccc2nc(C)c(C(I)I)c(N)c12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ DHFR P00374 2/20 0.36
▸ DCPS Q96C86 2/20 0.36
▸ LMNA P02545 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.33
▸ GRK3 P35626 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ TSHR P16473 1/20 0.33
▸ SYK P43405 2/20 0.33
▸ ACACB O00763 1/20 0.32
▸ SSTR4 P31391 1/20 0.32
▸ MTNR1A P48039 3/20 0.32
▸ MTNR1B P49286 3/20 0.32
▸ HTT P42858 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ NOTUM Q6P988 1/20 0.31

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
SCHEMBL10259023 0.86 MEN1 (0.38) DHFRDCPSLMNAALDH1A1GRK3
SCHEMBL10258758 0.86 MEN1 (0.38) DHFRDCPSLMNAALDH1A1GRK3
SCHEMBL10250836 0.81 KDM4E (0.40) DHFRDCPSLMNAKDM4ETSHR
SCHEMBL10252033 0.81 KDM4E (0.40) DHFRDCPSLMNAKDM4ETSHR
SCHEMBL27102660 0.71 RAB9A (0.40) ALDH1A1MTNR1AMTNR1B
SCHEMBL10257489 0.70 MAPK1 (0.44) LMNAKDM4EHTTMAPTNOTUM
SCHEMBL620994 0.70 ACACB (0.37) ALDH1A1KDM4EACACBMAPT
SCHEMBL621131 0.70 ACACB (0.37) ALDH1A1KDM4EACACBMAPT
SCHEMBL619123 0.70 ACACB (0.37) ALDH1A1KDM4EACACBMAPT
SCHEMBL27102662 0.69 ATM (0.44) LMNAALDH1A1HTT

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
WO-2012021837-A2 METHOD OF IMPROVING STABILITY OF SWEET ENHANCER AND COMPOSITION CONTAINING STABILIZED SWEET ENHANCER SENOMYX, INC. (US) 2012-02-16 — — WO disclosed
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