SCHEMBL4189932

SCHEMBL4189932

CCCCCCCc1ccc(-c2ccc(C(=O)NN)cc2)cc1

nearest known ligand 0.69

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RARB P10826 7/20 0.69
MEN1 O00255 2/20 0.69
KMT2A Q03164 2/20 0.69
ALDH1A1 P00352 1/20 0.69
RARA P10276 1/20 0.69
MAPT P10636 1/20 0.69
MTOR P42345 1/20 0.69
PLK1 P53350 3/20 0.59
SPHK2 Q9NRA0 2/20 0.58
SPHK1 Q9NYA1 2/20 0.58
THRA P10827 5/20 0.56
THRB P10828 5/20 0.56
HAO1 Q9UJM8 1/20 0.56
PLK3 Q9H4B4 2/20 0.54

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
SCHEMBL28709309 0.95 PLK1 (0.65) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL9206725 0.95 PLK1 (0.65) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL9164847 0.95 PLK1 (0.65) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL15174597 0.95 PLK1 (0.65) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL4824490 0.95 PLK1 (0.65) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL2747801 0.94 PLK1 (0.67) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL19443009 0.89 PLK1 (0.74) RARBALDH1A1MAPTPLK1SPHK2
SCHEMBL23484726 0.88 PLK1 (0.79) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL4185605 0.88 RARB (0.69) RARBMEN1KMT2AALDH1A1RARA
SCHEMBL2831713 0.87 TRPV1 (0.68) PLK1SPHK1THRATHRBPLK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220296579-A1 COMPOSITIONS AND METHODS FOR PROVIDING CARDIOPROTECTIVE EFFECTS CORNELL UNIVERSITY (US) 2022-09-22 US disclosed
US-11191755-B2 Compositions and methods for providing cardioprotective effects CORNELL UNIVERSITY (US) 2021-12-07 US disclosed
US-11160769-B2 Methods of treating metabolic syndrome related conditions using retinoic acid receptor agonists CORNELL UNIVERSITY (US) 2021-11-02 US disclosed
EP-3094380-B1 METHODS OF TREATING METABOLIC SYNDROME RELATED CONDITIONS USING RETINOIC ACID RECEPTOR AGONISTS UNIV CORNELL (US) 2021-04-28 EP disclosed
US-20090176837-A1 COMPOUNDS WITH ACTIVITY AT RETINOIC ACID RECEPTORS SONY CORPORATION (JP) 2009-07-09 US disclosed
US-20090176837-A1 COMPOUNDS WITH ACTIVITY AT RETINOIC ACID RECEPTORS SONY CORPORATION (JP) 2009-07-09 US disclosed
US-20090176837-A1 COMPOUNDS WITH ACTIVITY AT RETINOIC ACID RECEPTORS SONY CORPORATION (JP) 2009-07-09 US disclosed
WO-2007009083-A2 COMPOUNDS WITH ACTIVITY AT RETINOIC ACID RECEPTORS ACADIA PHARMACEUTICALS INC. (US) 2007-01-18 WO 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-20220296579-A1 COMPOSITIONS AND METHODS FOR PROVIDING CARDIOPROTECTIVE EFFECTS RARB, RARG, RARA RARB 1/4885MEN1 4881/4885KMT2A 4014/4885
US-11191755-B2 Compositions and methods for providing cardioprotective effects RARB, RARG, RARA RARB 1/4885MEN1 4881/4885KMT2A 4014/4885
US-11160769-B2 Methods of treating metabolic syndrome related conditions using retinoic acid receptor agonists RARA, RARG, RXRA RARB 5/4885MEN1 3112/4885KMT2A 2273/4885
US-20090176837-A1 COMPOUNDS WITH ACTIVITY AT RETINOIC ACID RECEPTORS RARB, RARA, RARG RARB 1/4885MEN1 4845/4885KMT2A 2499/4885

“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.