SCHEMBL6804446

SCHEMBL6804446

COc1ccc(C(=O)Oc2c(C(C)=O)ccc(OC)c2OC)cc1OC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.57
SMN1; SMN2 Q16637 4/20 0.52
TSHR P16473 3/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
KMT2A Q03164 7/20 0.49
ALDH1A1 P00352 3/20 0.49
MEN1 O00255 2/20 0.49
CA12 O43570 1/20 0.49
CA1 P00915 1/20 0.49
CA2 P00918 1/20 0.49
CA4 P22748 1/20 0.49
CA6 P23280 1/20 0.49
CA7 P43166 1/20 0.49
TPMT P51580 1/20 0.49
CA9 Q16790 1/20 0.49
CA14 Q9ULX7 1/20 0.49
KDM4E B2RXH2 1/20 0.48

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
SCHEMBL16510468 0.91 MAPT (0.47) MAPTSMN1; SMN2TSHRKMT2AALDH1A1
SCHEMBL6797429 0.89 TUBB1 (0.46) MAPTSMN1; SMN2KMT2AALDH1A1MEN1
SCHEMBL19866164 0.89 MAPT (0.46) MAPTSMN1; SMN2TSHRCYP1A2CYP3A4
SCHEMBL6613832 0.88 RAB9A (0.52) MAPTSMN1; SMN2KMT2AALDH1A1MEN1
SCHEMBL14702313 0.85 MAPT (0.46) MAPTTSHRCYP3A4KMT2AALDH1A1
SCHEMBL6803101 0.85 MAPT (0.54) MAPTSMN1; SMN2TSHRCYP1A2CYP3A4
SCHEMBL6803587 0.84 KMT2A (0.45) MAPTSMN1; SMN2KMT2AALDH1A1MEN1
SCHEMBL16704749 0.84 KMT2A (0.53) MAPTSMN1; SMN2TSHRCYP3A4KMT2A
SCHEMBL6612207 0.83 ALDH1A1 (0.60) SMN1; SMN2CYP1A2KMT2AALDH1A1MEN1
SCHEMBL1849992 0.82 MAPT (0.49) MAPTSMN1; SMN2TSHRCYP1A2CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040087582-A1 Phenyl derivatives MERCK PATENT GESELLSCHAFT (DE) 2004-05-06 US claimed
US-6710063-B1 Activators of PPAR delta SMITHKLINE BEECHAM CORPORATION 2004-03-23 US claimed
US-10426757-B2 Compositions and methods for promoting intestinal stem cell and/or non-stem progenitor cell function WHITEHEAD INSTITUTE FOR BIOMEDICAL RESEARCH (US) 2019-10-01 US disclosed
US-20040063665-A1 Substituted benzopyranones as telomerase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2004-04-01 US disclosed
US-20020160983-A1 Substituted benzopyranones as telomerase inhibitors PHARMACIA ITALIA S.P.A. (IT) 2002-10-31 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 (4 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-10426757-B2 Compositions and methods for promoting intestinal stem cell and/or non-stem progenitor cell function FABP2, ALPG, ALPI MAPT 4869/4885SMN1; SMN2 3086/4885TSHR 4242/4885
US-20020160983-A1 Substituted benzopyranones as telomerase inhibitors TERT, TERF2, TERF2IP MAPT 1629/4885SMN1; SMN2 1470/4885TSHR 3660/4885
US-20040087582-A1 Phenyl derivatives F2, F11, SERPINC1 MAPT 4360/4885SMN1; SMN2 3430/4885TSHR 1763/4885
US-20040063665-A1 Substituted benzopyranones as telomerase inhibitors TERT, TERF2, TERF2IP MAPT 1628/4885SMN1; SMN2 1466/4885TSHR 3682/4885

“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.