SCHEMBL4859112

SCHEMBL4859112

Cc1ccc(F)c(C(=O)N2CCC(c3cn(C)c4ccccc34)C2)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RORC P51449 5/20 0.47
HCRTR1 O43613 1/20 0.42
POLB P06746 1/20 0.42
SPR P35270 2/20 0.42
GFER P55789 1/20 0.42
HTR6 P50406 2/20 0.41
HSD11B1 P28845 3/20 0.40
ALDH1A1 P00352 2/20 0.39
USP2 O75604 1/20 0.39
PROKR1 Q8TCW9 1/20 0.39
TPSAB1 Q15661 2/20 0.39
LMNA P02545 1/20 0.38
MAPT P10636 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38

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
SCHEMBL5202338 0.84 GFER (0.47) RORCHCRTR1POLBSPRGFER
SCHEMBL5205062 0.81 SMO (0.46) POLBALDH1A1LMNAMAPTNPSR1
SCHEMBL4859672 0.74 HSD11B1 (0.52) HCRTR1POLBSPRGFERHSD11B1
SCHEMBL5201722 0.74 HTR2B (0.53) RORCPOLBALDH1A1USP2LMNA
SCHEMBL5203232 0.74 LMNA (0.51) POLBGFERHTR6HSD11B1ALDH1A1
SCHEMBL5462053 0.73 HRH2 (0.39) RORCTPSAB1
SCHEMBL5205864 0.72 RORC (0.46) RORCSPRHSD11B1ALDH1A1USP2
SCHEMBL5937364 0.72 ALDH1A1 (0.57) RORCPOLBSPRALDH1A1USP2
SCHEMBL5705162 0.72 RORC (0.51) RORCPOLBSPRALDH1A1USP2
SCHEMBL5204484 0.71 SLC2A1 (0.47) HSD11B1ALDH1A1PROKR1LMNAMAPT

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7368470-B2 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2008-05-06 US claimed
EP-1654253-B1 SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES GRUENENTHAL GMBH (DE) 2007-01-03 EP claimed
US-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2005-05-05 US claimed
US-7368470-B2 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2008-05-06 US disclosed
EP-1654253-B1 SUBSTITUTED 3-PYRROLIDIN-INDOLE DERIVATIVES GRUENENTHAL GMBH (DE) 2007-01-03 EP disclosed
US-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives GRUENENTHAL GMBH (DE) 2005-05-05 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-20050096376-A1 Substituted 3-pyrrolidine-indole derivatives OPRD1, OPRK1, TPH1 RORC 506/4885HCRTR1 623/4885POLB 1887/4885

“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.