SCHEMBL1948823

SCHEMBL1948823

CC(=O)N1CCc2cc(N(Cc3ccccc3)S(=O)(=O)c3ccn(C)n3)ccc2C1

nearest known ligand 0.48

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
HPGD P15428 2/20 0.48
RORC P51449 4/20 0.44
ALDH1A1 P00352 3/20 0.44
NPSR1 Q6W5P4 4/20 0.42
LMNA P02545 3/20 0.42
NOTUM Q6P988 1/20 0.41
HTT P42858 2/20 0.41
POLB P06746 1/20 0.41
OXTR P30559 2/20 0.40
AVPR1A P37288 2/20 0.40
TP53 P04637 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
PKM P14618 1/20 0.39
KMT2A Q03164 2/20 0.39
TMEM97 Q5BJF2 1/20 0.38
SIGMAR1 Q99720 1/20 0.38
MEN1 O00255 1/20 0.37
MAPT P10636 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL1948767 0.89 HPGD (0.45) HPGDALDH1A1NPSR1LMNAHTT
SCHEMBL1951603 0.88 HPGD (0.44) HPGDALDH1A1NPSR1LMNAHTT
SCHEMBL1948512 0.88 ESR2 (0.46) HPGDALDH1A1NPSR1LMNAHTT
SCHEMBL1948562 0.88 HPGD (0.47) HPGDALDH1A1NPSR1LMNAHTT
SCHEMBL1949528 0.88 HPGD (0.43) HPGDALDH1A1NPSR1LMNAHTT
SCHEMBL1949348 0.80 HTR2C (0.44) ALDH1A1LMNA
SCHEMBL1952905 0.77 GRM5 (0.39) HPGDLMNAHTTKMT2A
SCHEMBL1949522 0.77 LMNA (0.42) HPGDRORCALDH1A1NPSR1LMNA
SCHEMBL1949371 0.76 NOTUM (0.47) ALDH1A1LMNANOTUMPOLBPKM
SCHEMBL1950702 0.76 NOTUM (0.47) HPGDALDH1A1LMNANOTUMHTT

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-20110136860-A1 Compounds XENTION LTD. (GB) 2011-06-09 US claimed
US-20110136860-A1 Compounds XENTION LTD. (GB) 2011-06-09 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-20110136860-A1 Compounds NR3C2, NR5A1, NR0B2 HPGD 2321/4885RORC 131/4885ALDH1A1 1879/4885

“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.