SCHEMBL4291246

SCHEMBL4291246

COC(C(=O)N1CCC(CCc2ccccc2)(N2CCN(C)CC2)CC1)c1ccc2ccccc2n1

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.37
HSD17B10 Q99714 1/20 0.37
CHRM1 P11229 6/20 0.36
KDM4E B2RXH2 1/20 0.36
SMO Q99835 1/20 0.36
HCN1 O60741 2/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
LMNA P02545 1/20 0.34
HCN4 Q9Y3Q4 1/20 0.34
CYSLTR2 Q9NS75 1/20 0.34
CYSLTR1 Q9Y271 1/20 0.34
CSNK1A1 P48729 1/20 0.34
RAB9A P51151 1/20 0.34
HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL4272978 0.78 KDM4E (0.35) ALDH1A1CHRM1KDM4ESMOLMNA
SCHEMBL4273950 0.76 MAPK1 (0.36) ALDH1A1CHRM1KDM4EHRH4
SCHEMBL4280380 0.72 OPRM1 (0.47) ALDH1A1KDM4EMEN1KMT2ALMNA
SCHEMBL4283420 0.71 SLC6A3 (0.40) ALDH1A1LMNA
SCHEMBL3408526 0.65 BDKRB1 (0.49) ALDH1A1HSD17B10MEN1KMT2ARAB9A
SCHEMBL4132978 0.65 SIGMAR1 (0.44) ALDH1A1MEN1KMT2A
SCHEMBL28275217 0.64 KMT2A (0.52) ALDH1A1HSD17B10KDM4EMEN1KMT2A
SCHEMBL18390251 0.63 CHRM1 (0.74) HSD17B10CHRM1RAB9A
SCHEMBL13271645 0.61 HSD17B10 (0.61) ALDH1A1HSD17B10CHRM1KDM4E
SCHEMBL4119403 0.60 CARM1 (0.41) KMT2A

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-20090253669-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-10-08 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-20090253669-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 ALDH1A1 863/4885HSD17B10 2254/4885CHRM1 4649/4885

“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.