SCHEMBL4921010

SCHEMBL4921010

COC1=CC(=O)N(Cc2cc(OC)ccc2OC)C1

nearest known ligand 0.52

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 1/20 0.44
▸ KDM4E B2RXH2 3/20 0.44
▸ TSHR P16473 1/20 0.44
▸ TP53 P04637 1/20 0.44
▸ IDO1 P14902 2/20 0.43
▸ ADRA1A P35348 1/20 0.43
▸ TAAR1 Q96RJ0 1/20 0.43
▸ NPC1 O15118 1/20 0.43
▸ MAPT P10636 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.41
▸ HTR2A P28223 1/20 0.41
▸ TACR1 P25103 1/20 0.41

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
SCHEMBL4921404 0.79 GSK3A (0.53) KDM4EMAPTALDH1A1
SCHEMBL4923038 0.78 KMT2A (0.51) TSHRMAPTALDH1A1
SCHEMBL9831615 0.71 TACR1 (0.57) KDM4ETSHRTP53NPC1MAPT
SCHEMBL31190634 0.71 ELANE (0.48) KDM4EMAPTALDH1A1
SCHEMBL2657547 0.69 CA1 (0.35) MAPTALDH1A1
SCHEMBL9830022 0.69 KDM4E (0.68) KDM4ETSHRTP53NPC1MAPT
SCHEMBL805159 0.69 HSD17B10 (0.65) HSD17B10IDO1ADRA1ATAAR1MAPT
SCHEMBL7264952 0.68 MEN1 (0.48) HSD17B10KDM4ETSHRALDH1A1
SCHEMBL487942 0.67 HSD17B10 (0.62) HSD17B10IDO1ADRA1ATAAR1HTR2A
SCHEMBL21538245 0.67 KDM4E (0.67) KDM4ETSHRTP53NPC1MAPT

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-20080318943-A1 Compounds and Uses Thereof - 848 ASTRAZENECA AB (SE) 2008-12-25 — — 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-20080318943-A1 Compounds and Uses Thereof - 848 COMT, BACE1, BDNF HSD17B10 1559/4885KDM4E 2357/4885TSHR 265/4885

“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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