SCHEMBL660456

SCHEMBL660456

Cc1ccc(S(=O)(=O)NNC(=O)C2CCCN(CC(=O)c3ccccc3)C2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.55
POLB P06746 2/20 0.51
HTT P42858 1/20 0.51
CYP2D6 P10635 2/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
OPRM1 P35372 1/20 0.45
OPRK1 P41145 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.44
CYP3A4 P08684 1/20 0.44
KDM4E B2RXH2 2/20 0.43
MAPK1 P28482 1/20 0.43
ATM Q13315 1/20 0.43
LMNA P02545 1/20 0.42

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
SCHEMBL287258 0.89 ALDH1A1 (0.52) ALDH1A1POLBHTTMEN1KMT2A
SCHEMBL287681 0.87 ALDH1A1 (0.55) ALDH1A1POLBHTTCYP2D6MEN1
SCHEMBL287364 0.80 ALDH1A1 (0.51) ALDH1A1CYP2D6MEN1KMT2AL3MBTL1
SCHEMBL287096 0.74 ALDH1A1 (0.53) ALDH1A1HTTMEN1KMT2AKDM4E
SCHEMBL8247021 0.72 KMT2A (0.62) ALDH1A1CYP2D6MEN1KMT2ACYP3A4
SCHEMBL28079639 0.70 ALDH1A1 (0.70) ALDH1A1CYP2D6MEN1KMT2AL3MBTL1
SCHEMBL660676 0.70 KMT2A (0.38) ALDH1A1POLBMEN1KMT2ASMN1; SMN2
SCHEMBL287351 0.70 ALDH1A1 (0.51) ALDH1A1HTTCYP2D6MEN1KMT2A
SCHEMBL12424743 0.70 ALDH1A1 (0.66) ALDH1A1MEN1KMT2ASMN1; SMN2CYP3A4
SCHEMBL9079388 0.69 ALDH1A1 (0.47) ALDH1A1POLBCYP2D6MEN1KMT2A

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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 US claimed
US-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS DUTT CHAITANYA (IN) 2012-02-23 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-20120046317-A1 NOVEL HETEROCYCLIC COMPOUNDS AGER, REN, AGT ALDH1A1 676/4885POLB 2267/4885HTT 75/4885

“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.