SCHEMBL6974039

SCHEMBL6974039

CN1CC2CC(N3CCN(Cc4ccccc4)CC3)CC2C1

nearest known ligand 0.58

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MC4R P32245 1/20 0.58
SIGMAR1 Q99720 3/20 0.53
RECQL P46063 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
ACHE P22303 1/20 0.47
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
CCR3 P51677 1/20 0.45
TSHR P16473 1/20 0.45
DRD4 P21917 1/20 0.45
TRPV6 Q9H1D0 1/20 0.45
CHKA P35790 1/20 0.44

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
Hydrochloric Acid SCHEMBL3560252 0.86 MC4R (0.64) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL6979626 0.82 CYP2D6 (0.53) RECQLSMN1; SMN2LMNAKDM4EKMT2A
SCHEMBL7128583 0.82 DPP4 (0.49) SIGMAR1RECQLSMN1; SMN2LMNAKDM4E
SCHEMBL8193615 0.81 SIGMAR1 (0.55) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL3957969 0.81 MC4R (0.56) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL6972705 0.81 SIGMAR1 (0.55) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL13432148 0.80 MC4R (0.69) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL6607786 0.79 SIGMAR1 (0.53) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
Hydrochloric Acid SCHEMBL8186774 0.79 MC4R (0.54) MC4RSIGMAR1RECQLSMN1; SMN2LMNA
SCHEMBL6980525 0.79 RECQL (0.52) MC4RSIGMAR1RECQLSMN1; SMN2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. 2003-09-18 US disclosed
EP-1106615-B1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER (US) 2003-03-05 EP disclosed
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists OKUMURA YOSHIYUKI (JP) 2002-04-11 US disclosed
EP-1106615-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists PFIZER INC. (US) 2001-06-13 EP 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 (2 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-20030176445-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 MC4R 485/4885SIGMAR1 278/4885RECQL 3084/4885
US-20020042421-A1 Substituted 1,4-dihydropyridine compounds as bradykinin antagonists BDKRB1, BDKRB2, HRH4 MC4R 530/4885SIGMAR1 297/4885RECQL 3772/4885

“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.