SCHEMBL25514096

SCHEMBL25514096

Cc1sc(NC(=O)C(C)N)c(C(=O)c2ccc(Br)cc2)c1C

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 10/20 0.54
▸ MAPT P10636 8/20 0.54
▸ HPGD P15428 8/20 0.54
▸ LMNA P02545 4/20 0.54
▸ MAPK1 P28482 2/20 0.54
▸ PLA2G1B P04054 1/20 0.54
▸ ATG4B Q9Y4P1 1/20 0.54
▸ SMN1; SMN2 Q16637 4/20 0.50
▸ NPSR1 Q6W5P4 2/20 0.47
▸ HTT P42858 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.47
▸ L3MBTL1 Q9Y468 1/20 0.46
▸ RAB9A P51151 4/20 0.46
▸ KDM4E B2RXH2 3/20 0.46
▸ NPC1 O15118 3/20 0.46
▸ GRIN2C Q14957 2/20 0.46
▸ CYP1A2 P05177 1/20 0.46
▸ POLB P06746 1/20 0.46
▸ CYP2C9 P11712 1/20 0.46
▸ CYP2C19 P33261 1/20 0.46

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
SCHEMBL30012531 0.88 ALDH1A1 (0.60) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL18551518 0.84 ALDH1A1 (0.52) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL18591884 0.79 ALDH1A1 (0.44) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL21410205 0.76 ALDH1A1 (0.52) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL31498681 0.75 ALDH1A1 (0.57) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL17165585 0.75 ALDH1A1 (0.57) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL17165584 0.75 ALDH1A1 (0.57) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL23801148 0.73 ALDH1A1 (0.58) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL23801147 0.73 ALDH1A1 (0.58) ALDH1A1MAPTHPGDLMNAMAPK1
SCHEMBL21612864 0.73 ALDH1A1 (0.55) ALDH1A1MAPTHPGDLMNAMAPK1

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-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY KYOWA KIRIN CO., LTD. (JP) 2023-05-25 — — 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-20230159554-A1 COMPOUND WITH ANTICANCER ACTIVITY TP53, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, RCC2 ALDH1A1 199/4885MAPT 3226/4885HPGD 3514/4885

“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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