SCHEMBL1104896

SCHEMBL1104896

COc1cc(OC)c(C(=O)CC(C)=O)cc1Cc1cccc(Cl)c1F

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
METTL3 Q86U44 1/20 0.47
CSF1R P07333 1/20 0.39
EGFR P00533 6/20 0.38
PDE3B Q13370 1/20 0.38
PDE3A Q14432 1/20 0.38
LMNA P02545 1/20 0.38
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.37
MRGPRX4 Q96LA9 1/20 0.36
DHODH Q02127 1/20 0.36
CYP3A4 P08684 1/20 0.36

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
SCHEMBL13927525 0.92 METTL3 (0.46) METTL3CSF1REGFRPDE3BPDE3A
SCHEMBL1104898 0.88 METTL3 (0.49) METTL3CSF1REGFRPDE3BPDE3A
SCHEMBL4209881 0.87 METTL3 (0.48) METTL3CSF1RPDE3BPDE3ALMNA
SCHEMBL1104885 0.87 METTL3 (0.44) METTL3CSF1REGFRPDE3BPDE3A
SCHEMBL4207612 0.87 METTL3 (0.50) METTL3CSF1REGFRPDE3BPDE3A
SCHEMBL1104891 0.86 METTL3 (0.56) METTL3CSF1RKDM4EALDH1A1MRGPRX4
SCHEMBL18627847 0.85 METTL3 (0.43) METTL3CSF1REGFRPDE3BPDE3A
Hydrochloric Acid SCHEMBL4211289 0.85 METTL3 (0.55) METTL3CSF1RKDM4EALDH1A1MRGPRX4
SCHEMBL13927561 0.83 METTL3 (0.48) METTL3CSF1REGFRPDE3BPDE3A
SCHEMBL13927523 0.82 METTL3 (0.48) METTL3CSF1REGFRPDE3BPDE3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8383819-B2 Method for producing 4-oxoquinoline compound JAPAN TOBACCO INC. (JP) 2013-02-26 US disclosed
US-8153801-B2 Process and intermediates for preparing integrase inhibitors GILEAD SCIENCES, INC. (US) 2012-04-10 US disclosed
US-20100292480-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC (US) 2010-11-18 US disclosed
US-7825252-B2 Process and intermediates for preparing integrase inhibitors GILEAD SCIENCES, INC. (US) 2010-11-02 US disclosed
US-20090099366-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2009-04-16 US disclosed
US-20090036684-A1 METHOD FOR PRODUCING 4-OXOQUINOLINE COMPOUND SHIONOGI & CO., LTD. (JP) 2009-02-05 US disclosed
US-20080125594-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS GILEAD SCIENCES, INC. (US) 2008-05-29 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-20090099366-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS TYMS, TYMP, POLB METTL3 2511/4885CSF1R 3385/4885EGFR 4014/4885
US-20080125594-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS TYMS, TYMP, POLB METTL3 2511/4885CSF1R 3385/4885EGFR 4014/4885
US-20100292480-A1 PROCESS AND INTERMEDIATES FOR PREPARING INTEGRASE INHIBITORS TYMS, TYMP, POLB METTL3 2511/4885CSF1R 3385/4885EGFR 4014/4885
US-20090036684-A1 METHOD FOR PRODUCING 4-OXOQUINOLINE COMPOUND IMPDH1, IMPDH2, CDK20 METTL3 938/4885CSF1R 3788/4885EGFR 4526/4885

“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.