SCHEMBL17169171

SCHEMBL17169171

CCc1cc(OCc2ccccc2)ccc1C1C(=O)CC(CCSc2ccc(C)cn2)C=C1O

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NMT1 P30419 7/20 0.37
NMT2 O60551 3/20 0.36
ESR1 P03372 1/20 0.35
MAOB P27338 2/20 0.33
GABRA1 P14867 1/20 0.32
GABRG2 P18507 1/20 0.32
GABRB3 P28472 1/20 0.32
GABRA5 P31644 1/20 0.32
GABRA3 P34903 1/20 0.32
GABRA2 P47869 1/20 0.32
MEN1 O00255 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KMT2A Q03164 1/20 0.32
S1PR1 P21453 1/20 0.32
S1PR5 Q9H228 1/20 0.32

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
SCHEMBL13535007 0.62 P4HTM (0.49) NMT1MAOB
SCHEMBL8070497 0.61 MAOB (0.61) MAOBMEN1KMT2A
SCHEMBL20394187 0.59 ALOX5 (0.54) MAOBMEN1KMT2AS1PR1S1PR5
SCHEMBL6035603 0.59 MAOB (0.64) MAOB
SCHEMBL4816779 0.57 MEN1 (0.63) NMT1NMT2MAOBGABRA1GABRG2
SCHEMBL12158512 0.57 S1PR1 (0.59) MAOBMEN1KMT2AS1PR1S1PR5
SCHEMBL20526908 0.57 MAOB (0.56) MAOB
SCHEMBL2955611 0.57 LTB4R (0.64) MAOBMEN1KMT2A
SCHEMBL1898263 0.57 MAOB (0.55) MAOB
SCHEMBL15935622 0.57 LIPE (0.51) MAOBMEN1KMT2A

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-9414588-B2 Herbicide composition SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-16 US disclosed
US-20150289505-A1 HERBICIDE COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2015-10-15 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150289505-A1 HERBICIDE COMPOSITION DDT, DHFR, DERL1 NMT1 518/4885NMT2 310/4885ESR1 1963/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.