SCHEMBL14043554

SCHEMBL14043554

O=C(NC1CCCCC1)c1ccc2c(c1)N=C(c1ccc(F)cc1)c1ccccc1S2

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 5/20 0.59
TP53 P04637 6/20 0.57
SMN1; SMN2 Q16637 2/20 0.57
LMNA P02545 4/20 0.57
POLB P06746 1/20 0.57
MAPT P10636 1/20 0.53
CNR2 P34972 1/20 0.52
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
MEN1 O00255 1/20 0.50
KMT2A Q03164 1/20 0.50

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
SCHEMBL13808042 0.99 CNR1 (0.60) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13807990 0.91 TP53 (0.55) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13808007 0.91 TP53 (0.67) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL5064860 0.90 CNR1 (0.57) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13808038 0.90 TP53 (0.56) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13808039 0.90 CNR1 (0.67) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL8212339 0.89 CNR1 (0.47) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13807981 0.89 TP53 (0.59) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL14206276 0.88 TP53 (0.57) CNR1TP53SMN1; SMN2LMNAPOLB
SCHEMBL13808044 0.87 TP53 (0.60) CNR1TP53SMN1; SMN2LMNAPOLB

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
WO-2008118141-A2 USE OF CANNABINOID MODULATING COMPOUNDS IN COMBINATION WITH OTHER THERAPEUTIC COMPOUNDS FOR ADJUNCTIVE THERAPY ACADIA PHARMACEUTICALS INC. (US) 2008-10-02 WO disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2008-04-17 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
US-20070105819-A1 CB-1 modulating compounds and their use ACADIA PHARMACEUTICALS, INC. 2007-05-10 US disclosed
WO-2007047737-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE ACADIA PHARMACEUTICALS INC. (US) 2007-04-26 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 (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-20070105819-A1 CB-1 modulating compounds and their use CNR1, CNR2, FAAH CNR1 1/4885TP53 4870/4885SMN1; SMN2 2143/4885
US-20080090805-A1 CB-1 MODULATING COMPOUNDS AND THEIR USE CNR1, CNR2, FAAH CNR1 1/4885TP53 4870/4885SMN1; SMN2 2143/4885

“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.