SCHEMBL4635251

SCHEMBL4635251

Cc1ccc(S(=O)(=O)Nc2ccc(C(=O)N3CC4C(N)C4C3)cc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CRHBP P24387 5/20 0.71
CRHR2 Q13324 5/20 0.71
NPC1 O15118 1/20 0.67
RAB9A P51151 1/20 0.67
KMT2A Q03164 3/20 0.57
HTT P42858 3/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
KDM4E B2RXH2 1/20 0.57
MAPT P10636 2/20 0.56
HPGD P15428 1/20 0.56
LMNA P02545 2/20 0.54
ALDH1A1 P00352 2/20 0.53
PKM P14618 1/20 0.53
MEN1 O00255 1/20 0.51
ALOX12 P18054 1/20 0.51

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
SCHEMBL4635095 0.88 KMT2A (0.70) CRHBPCRHR2NPC1RAB9AKMT2A
SCHEMBL17319245 0.84 CRHBP (0.77) CRHBPCRHR2NPC1RAB9AKMT2A
SCHEMBL15154944 0.84 CRHBP (0.77) CRHBPCRHR2NPC1RAB9AKMT2A
SCHEMBL4636574 0.83 PKM (0.56) CRHBPCRHR2KMT2AHPGDLMNA
SCHEMBL4635923 0.82 CRHBP (0.47) CRHBPCRHR2NPC1RAB9AKMT2A
SCHEMBL4635298 0.80 ALDH1A1 (0.64) CRHBPCRHR2KMT2ASMN1; SMN2MAPT
SCHEMBL4895759 0.79 CA12 (0.52) CRHBPCRHR2NPC1RAB9AKMT2A
SCHEMBL4573407 0.75 HPGD (0.74) NPC1RAB9AKMT2ASMN1; SMN2MAPT
SCHEMBL6318007 0.75 HPGD (0.74) NPC1RAB9AKMT2ASMN1; SMN2MAPT
SCHEMBL28170795 0.74 MAPT (0.79) NPC1RAB9AKMT2ASMN1; SMN2MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors RANBAXY LABORATORIES LIMITED (IN) 2008-12-04 US disclosed
EP-1931633-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS Ranbaxy Laboratories Limited (IN) 2008-06-18 EP disclosed
WO-2007029086-A2 DERIVATIVES OF 3-AZABICYCLO[3.1.0]HEXANE AS DIPEPTIDYL PEPTIDASE-IV INHIBITORS RANBAXY LABORATORIES LIMITED (IN) 2007-03-15 WO 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-20080300251-A1 Derivatives of 3-Azabicyclo[3.1.0] Hexane as Dipeptidyl Peptidase-IV Inhibitors DPP4, DPP3, DPP8 CRHBP 3617/4885CRHR2 3179/4885NPC1 1978/4885

“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.