SCHEMBL6803587

SCHEMBL6803587

COc1ccc(C(C)=O)c(OC(=O)c2ccc(F)cc2)c1OC

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.45
ALDH1A1 P00352 5/20 0.45
MEN1 O00255 2/20 0.45
MAPT P10636 3/20 0.44
GAA P10253 3/20 0.43
SMN1; SMN2 Q16637 4/20 0.42
ATM Q13315 2/20 0.42
KRAS P01116 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
RAB9A P51151 3/20 0.42
NPC1 O15118 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
KDM4E B2RXH2 1/20 0.41
POLB P06746 1/20 0.41
TUBB1 Q9H4B7 2/20 0.40
HSD11B1 P28845 1/20 0.40
HPGD P15428 1/20 0.40
ABCG2 Q9UNQ0 1/20 0.40

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
SCHEMBL6613832 0.86 RAB9A (0.52) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL16704749 0.86 KMT2A (0.53) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL6797429 0.85 TUBB1 (0.46) KMT2AALDH1A1MEN1MAPTGAA
SCHEMBL6804446 0.84 MAPT (0.57) KMT2AALDH1A1MEN1MAPTGAA
SCHEMBL6612207 0.84 ALDH1A1 (0.60) KMT2AALDH1A1MEN1SMN1; SMN2RAB9A
SCHEMBL1849992 0.84 MAPT (0.49) KMT2AALDH1A1MEN1MAPTGAA
SCHEMBL6804594 0.83 KMT2A (0.43) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL16510468 0.81 MAPT (0.47) KMT2AALDH1A1MEN1MAPTSMN1; SMN2
SCHEMBL19866164 0.80 MAPT (0.46) KMT2AALDH1A1MEN1MAPTGAA
SCHEMBL16844183 0.80 KMT2A (0.44) KMT2AALDH1A1MEN1MAPTGAA

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-9504674-B2 TrkB agonists and methods of use EMORY UNIVERSITY (US) 2016-11-29 US disclosed
US-20150174107-A1 TRKB AGONISTS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2015-06-25 US disclosed
US-9029561-B2 TRKB agonists and methods of use EMORY UNIVERSITY (US) 2015-05-12 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 (3 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-20150174107-A1 TRKB AGONISTS AND METHODS OF USE NTRK2, BDNF, NTRK1 KMT2A 1006/4885ALDH1A1 1274/4885MEN1 4641/4885
US-20020160983-A1 Substituted benzopyranones as telomerase inhibitors TERT, TERF2, TERF2IP KMT2A 1256/4885ALDH1A1 1247/4885MEN1 3011/4885
US-20040063665-A1 Substituted benzopyranones as telomerase inhibitors TERT, TERF2, TERF2IP KMT2A 1252/4885ALDH1A1 1265/4885MEN1 2989/4885

“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.