SCHEMBL23657647

SCHEMBL23657647

Cc1ccc(-c2c(C)sc(NC(=O)c3cccnc3)c2C(N)=O)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.58
▸ KMT2A Q03164 3/20 0.58
▸ USP2 O75604 1/20 0.58
▸ ALDH1A1 P00352 11/20 0.58
▸ RAB9A P51151 6/20 0.58
▸ NPC1 O15118 5/20 0.58
▸ MAPT P10636 3/20 0.58
▸ FLT3 P36888 1/20 0.58
▸ POLB P06746 2/20 0.57
▸ TDP1 Q9NUW8 2/20 0.57
▸ HPGD P15428 6/20 0.55
▸ XBP1 P17861 1/20 0.52
▸ KDM4E B2RXH2 6/20 0.50
▸ LMNA P02545 3/20 0.50
▸ SMN1; SMN2 Q16637 2/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CASP1 P29466 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ L3MBTL1 Q9Y468 1/20 0.50
▸ ANO1 Q5XXA6 1/20 0.47

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
SCHEMBL14305225 0.80 ALDH1A1 (0.63) MEN1KMT2AUSP2ALDH1A1RAB9A
SCHEMBL2304917 0.75 ALDH1A1 (0.84) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL7004583 0.74 MEN1 (0.61) MEN1KMT2AUSP2ALDH1A1RAB9A
SCHEMBL5457779 0.73 RAB9A (1.00) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL1971026 0.71 NAMPT (0.78) KMT2AALDH1A1RAB9ANPC1MAPT
Niacinamide SCHEMBL28849073 0.71 F7 (0.81) KMT2AALDH1A1RAB9ANPC1MAPT
SCHEMBL12248945 0.70 LMNA (0.80) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL21247046 0.70 ALDH1A1 (0.66) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL12998105 0.69 NPC1 (0.64) MEN1KMT2AALDH1A1RAB9ANPC1
SCHEMBL21347432 0.69 RAB9A (0.78) MEN1KMT2AALDH1A1RAB9ANPC1

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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE EDIGENE BIOTECHNOLOGY, INC. (CN) 2021-07-22 — — 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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE AHR, ARNT, ARSA MEN1 4634/4885KMT2A 503/4885USP2 616/4885

“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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