SCHEMBL16690803

SCHEMBL16690803

COc1ccc(Cl)cc1NC(=O)N1CCN(CCc2ccccc2)CC1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 1.00
RBP4 P02753 7/20 0.70
SMN1; SMN2 Q16637 3/20 0.62
MAPT P10636 3/20 0.61
LMNA P02545 1/20 0.58
TP53 P04637 1/20 0.58
THRB P10828 1/20 0.57
GAA P10253 2/20 0.56
POLB P06746 1/20 0.56
KMT2A Q03164 2/20 0.56
ALDH1A1 P00352 2/20 0.56
TSHR P16473 1/20 0.56
NPSR1 Q6W5P4 1/20 0.56
MEN1 O00255 1/20 0.55
L3MBTL1 Q9Y468 1/20 0.55

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
SCHEMBL4307202 0.87 MAPK1 (0.77) MAPK1RBP4MAPTLMNATHRB
SCHEMBL4306582 0.83 MAPT (0.73) MAPK1RBP4MAPTLMNATHRB
SCHEMBL16690825 0.82 RBP4 (1.00) MAPK1RBP4MAPTLMNATP53
SCHEMBL16690852 0.81 RBP4 (1.00) MAPK1RBP4MAPTLMNATP53
SCHEMBL16690804 0.79 RBP4 (1.00) MAPK1RBP4MAPTLMNAGAA
SCHEMBL4301167 0.79 MAPT (0.67) MAPK1RBP4MAPTLMNATHRB
SCHEMBL16690853 0.79 ALDH1A1 (0.81) MAPK1RBP4SMN1; SMN2MAPTKMT2A
SCHEMBL16690848 0.77 RBP4 (0.83) MAPK1RBP4MAPTLMNATHRB
SCHEMBL16690846 0.76 RBP4 (0.77) MAPK1RBP4SMN1; SMN2MAPTLMNA
SCHEMBL16690815 0.76 MAPT (0.78) MAPK1RBP4SMN1; SMN2MAPTLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287607-A1 NON-RETINOID ANTAGONISTS FOR TREATMENT OF AGE-RELATED MACULAR DEGENERATION AND STARGARDT DISEASE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-10-06 US disclosed
US-9333202-B2 Non-retinoid antagonists for treatment of age-related macular degeneration and stargardt disease THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2016-05-10 US disclosed
US-20150126494-A1 NON-RETINOID ANTAGONISTS FOR TREATMENT OF AGE-RELATED MACULAR DEGENERATION AND STARGARDT DISEASE THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2015-05-07 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-20150126494-A1 NON-RETINOID ANTAGONISTS FOR TREATMENT OF AGE-RELATED MACULAR DEGENERATION AND STARGARDT DISEASE RBP4, RBP1, LRAT MAPK1 2400/4885RBP4 1/4885SMN1; SMN2 366/4885
US-20160287607-A1 NON-RETINOID ANTAGONISTS FOR TREATMENT OF AGE-RELATED MACULAR DEGENERATION AND STARGARDT DISEASE RBP4, RBP1, LRAT MAPK1 2400/4885RBP4 1/4885SMN1; SMN2 366/4885

“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.