SCHEMBL16689607

SCHEMBL16689607

CC(C)C(=O)c1ccnc(C(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DDR1 Q08345 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.43
▸ DBH P09172 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ VNN1 O95497 1/20 0.43
▸ SMARCA2 P51531 1/20 0.42
▸ SMARCA4 P51532 1/20 0.42
▸ MEN1 O00255 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ LOXL2 Q9Y4K0 2/20 0.41
▸ LOX P28300 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
SCHEMBL30252196 0.90 VNN1 (0.43) DDR1VNN1SMARCA2SMARCA4MEN1
SCHEMBL30016958 0.81 SMARCA2 (0.49) DDR1VNN1SMARCA2SMARCA4LMNA
SCHEMBL16690807 0.81 SMARCA2 (0.49) DDR1VNN1SMARCA2SMARCA4LMNA
SCHEMBL28019417 0.80 VNN1 (0.58) DDR1VNN1SMARCA2SMARCA4LOXL2
SCHEMBL15720866 0.80 JMJD6 (0.52) VNN1MEN1KMT2A
SCHEMBL29427285 0.79 KDM5C (0.55) KDM4EVNN1SMARCA2SMARCA4LOXL2
SCHEMBL503171 0.79 KDM5C (0.55) KDM4EVNN1SMARCA2SMARCA4LOXL2
SCHEMBL13890754 0.77 KDM4E (0.47) KDM4EDBHGAARECQLLOXL2
SCHEMBL25221330 0.77 VNN1 (0.46) DDR1VNN1SMARCA2SMARCA4LMNA
SCHEMBL29427234 0.77 LOXL2 (0.49) DDR1VNN1SMARCA2SMARCA4LOXL2

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 DDR1 535/4885KDM4E 4674/4885DBH 805/4885
US-20160287607-A1 NON-RETINOID ANTAGONISTS FOR TREATMENT OF AGE-RELATED MACULAR DEGENERATION AND STARGARDT DISEASE RBP4, RBP1, LRAT DDR1 535/4885KDM4E 4674/4885DBH 805/4885

“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.

Send feedback