SCHEMBL14545010

SCHEMBL14545010

Cc1occc1C(=O)N1CCN(c2cnc(-c3ccc(C(F)(F)F)cc3)c(-c3ccncc3Cl)n2)CC1

nearest known ligand 0.62

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 6/20 0.62
CNR2 P34972 2/20 0.62
KDM4E B2RXH2 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.42
LMNA P02545 4/20 0.42
HTT P42858 3/20 0.42
ALDH1A1 P00352 2/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
GLA P06280 1/20 0.41
EPHX2 P34913 1/20 0.41
CKS1B P61024 4/20 0.40
SKP1 P63208 4/20 0.40
SKP2 Q13309 4/20 0.40

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
SCHEMBL14545472 0.91 CNR1 (0.49) CNR1CNR2KDM4ESMN1; SMN2LMNA
SCHEMBL14545074 0.89 CNR1 (0.62) CNR1CNR2KDM4ESMN1; SMN2LMNA
SCHEMBL14545675 0.83 CNR1 (0.70) CNR1CNR2CKS1BSKP1SKP2
SCHEMBL14545434 0.83 CNR1 (0.70) CNR1CNR2CKS1BSKP1SKP2
SCHEMBL14545360 0.83 CNR1 (0.72) CNR1CNR2KDM4ECKS1BSKP1
SCHEMBL14545070 0.83 CNR1 (0.63) CNR1CNR2KDM4ESMN1; SMN2LMNA
SCHEMBL14545101 0.83 LMNA (0.44) CNR1CNR2SMN1; SMN2LMNAHTT
SCHEMBL14545354 0.83 CNR1 (0.71) CNR1CNR2CKS1BSKP1SKP2
SCHEMBL14545433 0.83 CNR1 (0.71) CNR1CNR2CKS1BSKP1SKP2
SCHEMBL14544989 0.83 ALDH1A1 (0.46) CNR1CNR2KDM4ESMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070078135-A1 Substituted heteroaryl CB1 antagonists NEUROGEN CORPORATION (US) 2007-04-05 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-20070078135-A1 Substituted heteroaryl CB1 antagonists CNR1, CNR2, OPRL1 CNR1 1/4885CNR2 2/4885KDM4E 1408/4885

“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.