SCHEMBL6125407

SCHEMBL6125407

FCn1ccc2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CDK4 P11802 4/20 0.68
CCND1 P24385 4/20 0.68
KMT2A Q03164 2/20 0.55
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR6 P50406 2/20 0.52
LMNA P02545 1/20 0.50
MAPK1 P28482 2/20 0.46
HTT P42858 1/20 0.46
TSHR P16473 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
PLAU P00749 1/20 0.45
ALDH1A1 P00352 1/20 0.44

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
SCHEMBL17822342 0.83 CDK4 (0.76) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL29379363 0.83 CDK4 (0.76) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL11366447 0.81 CDK4 (1.00) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL945970 0.79 CDK4 (0.71) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL1629560 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL13227451 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL32678601 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL1616222 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL315923 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C
SCHEMBL32678603 0.77 CDK4 (0.68) CDK4CCND1KMT2AHTR2AHTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10040783-B2 Prostaglandin receptor EP2 antagonists, derivatives, compositions, and uses related thereto EMORY UNIVERSITY (US) 2018-08-07 US disclosed
EP-2721011-B1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO UNIV EMORY (US) 2017-09-06 EP disclosed
US-20170081314-A1 Prostaglandin Receptor EP2 Antagonists, Derivatives, Compositions, and Uses Related Thereto NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2017-03-23 US disclosed
US-9518044-B2 Prostaglandin receptor EP2 antagonists, derivatives, compositions, and uses related thereto EMORY UNIVERSITY (US) 2016-12-13 US disclosed
US-20140179750-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO EMORY UNIVERSITY (US) 2014-06-26 US disclosed
EP-2721011-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO Emory University (US) 2014-04-23 EP disclosed
WO-2012177618-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO EMORY UNIVERSITY (US) 2012-12-27 WO disclosed
US-8252944-B2 Process for preparing heteroaromatic ring compound having N-Rf group DAIKIN INDUSTRIES, LTD. (JP) 2012-08-28 US disclosed
US-20120116097-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP DAIKIN INDUSTRIES, LTD. (JP) 2012-05-10 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-10040783-B2 Prostaglandin receptor EP2 antagonists, derivatives, compositions, and uses related thereto PTGER2, PTGES2, PTGES CDK4 1290/4885CCND1 3954/4885KMT2A 2359/4885
US-20170081314-A1 Prostaglandin Receptor EP2 Antagonists, Derivatives, Compositions, and Uses Related Thereto PTGER2, PTGES2, PTGES CDK4 1290/4885CCND1 3954/4885KMT2A 2359/4885
US-20140179750-A1 PROSTAGLANDIN RECEPTOR EP2 ANTAGONISTS, DERIVATIVES, COMPOSITIONS, AND USES RELATED THERETO PTGER2, PTGES2, PTGES CDK4 1290/4885CCND1 3954/4885KMT2A 2359/4885
US-20120116097-A1 PROCESS FOR PREPARING HETEROAROMATIC RING COMPOUND HAVING N-Rf GROUP CYP2F1, AFF1, AFF2 CDK4 3291/4885CCND1 2044/4885KMT2A 980/4885

“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.