SCHEMBL11959782

SCHEMBL11959782

COc1ccc(C(=O)/C=C/c2ccc3c(c2)OCO3)cc1OC

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 5/20 0.72
▸ MEN1 O00255 3/20 0.65
▸ KMT2A Q03164 3/20 0.65
▸ ABCB1 P08183 1/20 0.64
▸ POLB P06746 1/20 0.64
▸ MAPT P10636 8/20 0.64
▸ ALDH1A1 P00352 3/20 0.64
▸ CYP3A4 P08684 2/20 0.64
▸ CYP2D6 P10635 2/20 0.64
▸ CYP2C9 P11712 2/20 0.64
▸ CYP2C19 P33261 2/20 0.64
▸ KDM4E B2RXH2 1/20 0.64
▸ RAB9A P51151 2/20 0.64
▸ STAT1 P42224 1/20 0.64
▸ TNFRSF1A P19438 1/20 0.63
▸ LMNA P02545 2/20 0.62
▸ NPSR1 Q6W5P4 2/20 0.62
▸ ATM Q13315 1/20 0.62

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
SCHEMBL28549138 0.95 ABCG2 (0.71) ABCG2MEN1KMT2APOLBMAPT
SCHEMBL3192412 0.88 ABCG2 (0.69) ABCG2MEN1KMT2APOLBMAPT
SCHEMBL3192428 0.88 ABCG2 (0.69) ABCG2MEN1KMT2APOLBMAPT
SCHEMBL3173761 0.88 TNFRSF1A (0.72) ABCG2ABCB1MAPTALDH1A1CYP3A4
SCHEMBL3173746 0.88 TNFRSF1A (0.72) ABCG2ABCB1MAPTALDH1A1CYP3A4
SCHEMBL28553855 0.86 MAPT (0.79) MAPTALDH1A1CYP3A4CYP2D6CYP2C9
SCHEMBL108665 0.86 MAPT (0.79) MAPTALDH1A1CYP3A4CYP2D6CYP2C9
SCHEMBL13776922 0.85 MAPT (0.86) ABCG2MEN1KMT2AMAPTALDH1A1
SCHEMBL2458577 0.84 ABCG2 (1.00) ABCG2MEN1KMT2AABCB1MAPT
SCHEMBL2458579 0.84 ABCG2 (1.00) ABCG2MEN1KMT2AABCB1MAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130023567-A1 Novel Compounds SPEAR THERAPEUTICS LIMITED (GB) 2013-01-24 — — US disclosed
US-20130023567-A1 Novel Compounds SPEAR THERAPEUTICS LIMITED (GB) 2013-01-24 — — US disclosed
US-8236827-B2 Compounds SPEAR THERAPEUTICS LIMITED (GB) 2012-08-07 — — US disclosed
US-8236827-B2 Compounds SPEAR THERAPEUTICS LIMITED (GB) 2012-08-07 — — US disclosed
US-20100168180-A1 Novel Compounds SPEAR THERAPEUTICS LIMITED (GB) 2010-07-01 — — US disclosed
US-20100168180-A1 Novel Compounds SPEAR THERAPEUTICS LIMITED (GB) 2010-07-01 — — 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 (2 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-20100168180-A1 Novel Compounds HRAS, MCL1, KRAS ABCG2 1608/4885MEN1 370/4885KMT2A 1361/4885
US-20130023567-A1 Novel Compounds MKI67, RB1, CCND1 ABCG2 1606/4885MEN1 1191/4885KMT2A 1031/4885

“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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