SCHEMBL21116634

SCHEMBL21116634

Cc1cccc(OCCNC(=O)C2(C)C=C(NC(=O)COc3ccc(Cl)cc3)C2)c1

nearest known ligand 0.55

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PPARD Q03181 1/20 0.55
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ POLB P06746 3/20 0.48
▸ NPY1R P25929 2/20 0.46
▸ ALDH1A1 P00352 1/20 0.45
▸ NPY2R P49146 1/20 0.45
▸ MAPK1 P28482 3/20 0.44
▸ GAA P10253 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ HTT P42858 2/20 0.44
▸ HPGD P15428 1/20 0.43
▸ RAB9A P51151 1/20 0.43
▸ LMNA P02545 1/20 0.43
▸ NPC1 O15118 1/20 0.43

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
SCHEMBL21116380 0.91 NPC1 (0.53) MEN1KMT2ANPY1RALDH1A1NPY2R
SCHEMBL21116592 0.91 KMT2A (0.47) MEN1KMT2AALDH1A1MAPTHTT
SCHEMBL21116381 0.90 TP53 (0.45) PPARDMEN1KMT2APOLBALDH1A1
SCHEMBL24116652 0.88 ALDH1A1 (0.50) POLBNPY1RALDH1A1NPY2RMAPK1
SCHEMBL21116984 0.86 DRD2 (0.44) MEN1KMT2AALDH1A1GAAHTT
SCHEMBL19577396 0.80 PPARD (0.56) PPARDMEN1KMT2APOLBNPY1R
SCHEMBL24322995 0.76 PPARD (0.58) PPARDMEN1KMT2APOLBALDH1A1
SCHEMBL20999620 0.75 ATF4 (0.50) MEN1KMT2APOLBALDH1A1GAA
SCHEMBL23263844 0.74 KMT2A (0.46) MEN1KMT2APOLBALDH1A1MAPK1
SCHEMBL19569418 0.73 ATF4 (0.74) MEN1KMT2APOLBNPY1RALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10836725-B2 Modulators of the integrated stress pathway ABBVIE INC. (US) 2020-11-17 — — US disclosed
US-20190194135-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC 2019-06-27 — — 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-10836725-B2 Modulators of the integrated stress pathway ATF4, ATF1, DDIT3 PPARD 1954/4885MEN1 4714/4885KMT2A 4320/4885
US-20190194135-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 PPARD 1954/4885MEN1 4714/4885KMT2A 4320/4885

“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.

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