SCHEMBL18479367

SCHEMBL18479367

CC(O)c1ccc(C(C)(C)CNc2ccc(C(C)(C)C)cn2)cn1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.39
▸ LMNA P02545 2/20 0.39
▸ MAPT P10636 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ CACNA1I Q9P0X4 1/20 0.38
▸ DEGS1 O15121 1/20 0.35
▸ HCAR3 P49019 2/20 0.33
▸ HCAR2 Q8TDS4 1/20 0.33
▸ NPC1 O15118 2/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ TP53 P04637 1/20 0.31
▸ TSHR P16473 1/20 0.31
▸ FAAH O00519 1/20 0.31
▸ ESR1 P03372 1/20 0.30
▸ ESR2 Q92731 1/20 0.30
▸ NUDT1 P36639 1/20 0.30

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
SCHEMBL21183939 0.88 RAB9A (0.37) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL14946753 0.82 CACNA1I (0.42) RAB9ALMNAMAPTSMN1; SMN2KMT2A
SCHEMBL17403570 0.76 RAB9A (0.46) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL12412536 0.73 HCAR3 (0.54) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL26199978 0.73 RAB9A (0.43) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL12293177 0.71 HCAR3 (0.50) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL24324469 0.71 HIF1A (0.39) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL13658047 0.71 LMNA (0.41) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL14946815 0.70 LMNA (0.38) RAB9ALMNAMAPTSMN1; SMN2MEN1
SCHEMBL24124013 0.70 RAB9A (0.43) RAB9ALMNAMAPTSMN1; SMN2MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10766886-B2 Retinoic acid receptor antagonists as chaperone-mediated autophagy modulators and uses thereof ALBERT EINSTEIN COLLEGE OF MEDICINE (US) 2020-09-08 — — US disclosed
US-20190225599-A1 RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTOPHAGY MODULATORS AND USES THEREOF ALBERT EINSTEIN COLLEGE MEDICINE INC (US) 2019-07-25 — — US disclosed
US-9890143-B2 Retinoic acid receptor antagonists as chaperone-mediated authophagy modulators and uses thereof ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) 2018-02-13 — — US disclosed
US-20170037039-A1 RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTHOPHAGY MODULATORS AND USES THEREOF ALBERT EINSTEIN COLLEGE OF MEDICINE, INC. (US) 2017-02-09 — — 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 (3 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-20170037039-A1 RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTHOPHAGY MODULATORS AND USES THEREOF RXRA, RARB, RARA RAB9A 402/4885LMNA 1121/4885MAPT 1343/4885
US-10766886-B2 Retinoic acid receptor antagonists as chaperone-mediated autophagy modulators and uses thereof RARA, RARB, RXRA RAB9A 285/4885LMNA 1280/4885MAPT 1742/4885
US-20190225599-A1 RETINOIC ACID RECEPTOR ANTAGONISTS AS CHAPERONE-MEDIATED AUTOPHAGY MODULATORS AND USES THEREOF RARA, RARB, RXRA RAB9A 285/4885LMNA 1280/4885MAPT 1742/4885

“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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