SCHEMBL4085535

SCHEMBL4085535

CCc1cc(-c2ccc(C(=O)C=CO)cc2)ccc1OC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 8/20 0.47
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
HSP90AA1 P07900 1/20 0.45
DNMT1 P26358 1/20 0.45
MAPT P10636 3/20 0.44
LMNA P02545 2/20 0.44
KDM4E B2RXH2 1/20 0.44
CAPN1 P07384 1/20 0.44
SRD5A2 P31213 1/20 0.43
HSD17B1 P14061 2/20 0.43
TNFRSF1A P19438 1/20 0.43
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
NPC1 O15118 1/20 0.41
RAB9A P51151 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
SCHEMBL4086023 0.81 HSD17B1 (0.64) MEN1KMT2ASRD5A2HSD17B1
SCHEMBL12325012 0.78 HSD17B1 (0.59) MAPTLMNAKDM4EHSD17B1
SCHEMBL4085532 0.75 KDM4E (0.60) ABCG2KMT2AHSP90AA1DNMT1KDM4E
SCHEMBL4085995 0.75 SMN1; SMN2 (0.54) MEN1KMT2AMAPTLMNASRD5A2
SCHEMBL23137322 0.74 ALDH1A1 (0.50) MEN1KMT2AHSP90AA1MAPTLMNA
SCHEMBL23137323 0.74 ALDH1A1 (0.50) MEN1KMT2AHSP90AA1MAPTLMNA
SCHEMBL4095528 0.74 ALDH1A1 (0.43) MEN1KMT2AMAPTLMNAKDM4E
SCHEMBL4098160 0.73 SRD5A2 (0.44) MEN1KMT2AMAPTSRD5A2HSD17B1
SCHEMBL4455774 0.72 HSD17B1 (0.43) MEN1KMT2ASRD5A2HSD17B1
SCHEMBL4085538 0.72 HSD17B1 (0.43) MEN1KMT2AHSD17B1

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-20090186900-A1 COMPOUND STERIX LIMITED (GB) 2009-07-23 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-20090186900-A1 COMPOUND HSD17B2, HSD17B11, CYP17A1 ABCG2 1752/4885MEN1 1122/4885KMT2A 2145/4885

“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.