SCHEMBL19419917

SCHEMBL19419917

COc1ccc(CC(=O)Cc2ccc(-c3noc(-c4ccc(C)cc4)n3)cc2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.73
▸ SMN1; SMN2 Q16637 5/20 0.73
▸ NPC1 O15118 4/20 0.73
▸ RAB9A P51151 4/20 0.73
▸ NPSR1 Q6W5P4 2/20 0.73
▸ KMT2A Q03164 6/20 0.62
▸ MEN1 O00255 4/20 0.62
▸ TP53 P04637 1/20 0.62
▸ TPH1 P17752 2/20 0.61
▸ MAPK1 P28482 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ S1PR1 P21453 1/20 0.58
▸ NR1H4 Q96RI1 1/20 0.58
▸ HSD17B10 Q99714 3/20 0.57
▸ CYP3A4 P08684 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ KDM4E B2RXH2 3/20 0.56
▸ HPGD P15428 2/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.56
▸ HAVCR2 Q8TDQ0 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
SCHEMBL17831085 0.90 KMT2A (0.62) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL12259206 0.89 KMT2A (0.61) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL16602947 0.78 NPC1 (0.83) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL1430356 0.78 NR1H4 (0.73) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL15920066 0.77 KMT2A (1.00) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL12310047 0.77 KMT2A (0.55) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL12267142 0.77 RAB9A (0.67) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL20777159 0.76 TPH1 (1.00) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL20777161 0.76 TPH1 (1.00) MAPTSMN1; SMN2NPC1RAB9ANPSR1
SCHEMBL14881833 0.76 MAPT (0.62) MAPTSMN1; SMN2NPC1RAB9ANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES UNITY BIOTECHNOLOGY, INC. 2017-10-05 — — 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 (1 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-20170281649-A1 COMPOUNDS AND THERAPEUTIC USES TP53, NQO1, SHMT2 MAPT 1762/4885SMN1; SMN2 595/4885NPC1 715/4885

“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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