SCHEMBL25911151

SCHEMBL25911151

O=C(CCCCc1ccccc1)N(Cc1cccnc1)Cc1ccc(Cl)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.48
PKM P14618 1/20 0.48
TBXAS1 P24557 7/20 0.48
MAPK1 P28482 1/20 0.47
PLAAT3 P53816 1/20 0.47
PLAAT5 Q96KN8 1/20 0.47
PLAAT2 Q9NWW9 1/20 0.47
PLAAT4 Q9UL19 1/20 0.47
HDAC8 Q9BY41 2/20 0.46
TP53 P04637 2/20 0.44
FNTA P49354 1/20 0.44
FNTB P49356 1/20 0.44
KMT2A Q03164 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 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
SCHEMBL25911152 0.87 TP53 (0.54) ALDH1A1PKMMAPK1HDAC8TP53
SCHEMBL25910972 0.84 ALDH1A1 (0.53) ALDH1A1MAPK1HDAC8TP53KMT2A
SCHEMBL25911142 0.84 ALDH1A1 (0.53) ALDH1A1PKMMAPK1HDAC8LMNA
SCHEMBL25911149 0.81 ALDH1A1 (0.50) ALDH1A1PKMMAPK1HDAC8KMT2A
SCHEMBL25910983 0.80 KDM4E (0.52) ALDH1A1MAPK1HDAC8FNTAFNTB
SCHEMBL25911025 0.80 GPBAR1 (0.52) ALDH1A1MAPK1HDAC8TP53FNTA
SCHEMBL25911014 0.79 PDK1 (0.52) ALDH1A1MAPK1HDAC8LMNA
SCHEMBL25911165 0.78 ALDH1A1 (0.49) ALDH1A1MAPK1HDAC8TP53KMT2A
SCHEMBL25911127 0.78 ALDH1A1 (0.51) ALDH1A1MAPK1HDAC8KMT2ALMNA
SCHEMBL25911163 0.78 ALDH1A1 (0.48) ALDH1A1PKMMAPK1HDAC8TP53

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-20230233541-A1 SUBSTITUTED BENZAMIDES AS MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. 2023-07-27 US disclosed
US-20230233541-A1 SUBSTITUTED BENZAMIDES AS MODULATORS OF TREX1 CONSTELLATION PHARMACEUTICALS, INC. 2023-07-27 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 (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-20230233541-A1 SUBSTITUTED BENZAMIDES AS MODULATORS OF TREX1 TREH, BRIX1, GBA1 ALDH1A1 327/4885PKM 2240/4885TBXAS1 5/4885

“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.