SCHEMBL10021803

SCHEMBL10021803

Cc1ccc(N2C(=O)c3cc(Oc4ccccc4)c4c5c(Oc6ccccc6)cc6c7c(cc(Oc8ccccc8)c(c8c(Oc9ccccc9)cc(c3c48)C2=O)c75)C(=O)N(c2ccc(C)cc2)C6=O)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 5/20 0.56
▸ MEN1 O00255 4/20 0.56
▸ ALDH1A1 P00352 3/20 0.48
▸ HTT P42858 1/20 0.45
▸ RAB9A P51151 2/20 0.44
▸ NPC1 O15118 1/20 0.44
▸ TSHR P16473 1/20 0.44
▸ CASP1 P29466 1/20 0.44
▸ CASP7 P55210 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ CA9 Q16790 2/20 0.44
▸ CA12 O43570 1/20 0.44
▸ CA1 P00915 1/20 0.44
▸ GRM5 P41594 1/20 0.43
▸ ADORA2A P29274 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.42
▸ NR1H2 P55055 1/20 0.42
▸ NR1H3 Q13133 1/20 0.42
▸ BRD4 O60885 1/20 0.42
▸ NTRK1 P04629 1/20 0.42

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
SCHEMBL18873949 0.90 GRM5 (0.44) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL24011859 0.86 MEN1 (0.47) KMT2AMEN1ALDH1A1HTTKDM4E
SCHEMBL13498707 0.81 DPP4 (0.46) KMT2AMEN1ALDH1A1TSHRHSD17B10
SCHEMBL10021805 0.80 MEN1 (0.37) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL21107869 0.78 KMT2A (0.63) KMT2AMEN1ALDH1A1RAB9ANPC1
SCHEMBL16285003 0.77 KMT2A (0.49) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL16285002 0.77 MEN1 (0.53) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL18950118 0.77 KMT2A (0.49) KMT2AMEN1ALDH1A1HTTRAB9A
SCHEMBL14279968 0.76 KMT2A (0.62) KMT2AMEN1ALDH1A1HTTGRM5
SCHEMBL24011822 0.76 GSTP1 (0.40) KMT2AALDH1A1GRM5NR1H2BRD4

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-20160266292-A1 Coatable Polymer Polarizer LIGHT POLYMERS HOLDING (KY) 2016-09-15 — — US disclosed
US-20120012790-A1 Complex salts for light emitting devices SOLVAY SA (BE) 2012-01-19 — — 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-20120012790-A1 Complex salts for light emitting devices CHRM1, CHRM2, CRY1 KMT2A 1900/4885MEN1 59/4885ALDH1A1 3561/4885

“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.

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