SCHEMBL5288314

SCHEMBL5288314

[CH2]c1cc(-c2ccccc2)nn1C1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 3/20 0.52
CNR2 P34972 2/20 0.52
HPGD P15428 1/20 0.50
FABP3 P05413 3/20 0.42
FABP4 P15090 3/20 0.42
KCNJ6 P48051 5/20 0.41
KCNJ3 P48549 5/20 0.41
KCNJ5 P48544 4/20 0.41
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
SLC18A3 Q16572 1/20 0.38
HTR2A P28223 1/20 0.38
HTR2C P28335 1/20 0.38
HTR2B P41595 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
SCHEMBL5288319 0.81 HPGD (0.54) CNR1CNR2HPGDFABP3FABP4
SCHEMBL22633243 0.81 HPGD (0.57) CNR1CNR2HPGDFABP3FABP4
SCHEMBL9057110 0.78 CNR1 (0.49) CNR1CNR2HPGDFABP3FABP4
SCHEMBL15319933 0.70 HPGD (0.55) CNR1CNR2HPGDKCNJ6KCNJ3
SCHEMBL29009128 0.69 HCRTR1 (0.45) CNR1CNR2HPGDNPC1RAB9A
SCHEMBL29152983 0.69 KMT2A (0.47) CNR1CNR2HPGDKCNJ6KCNJ3
SCHEMBL5285406 0.69 CNR1 (0.48) CNR1CNR2FABP3FABP4KCNJ6
SCHEMBL18592035 0.68 HPGD (0.49) CNR1CNR2HPGDKCNJ6KCNJ3
SCHEMBL2850095 0.68 NSD3 (0.54) CNR1CNR2FABP3FABP4HTR2A
SCHEMBL5280538 0.67 KMT2A (0.48) NPC1RAB9A

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
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO claimed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 US claimed
WO-2007001335-A2 RAMOPLANIN DERIVATIVES POSSESSING ANTIBACTERIAL ACTIVITY VICURON PHARMACEUTICALS INC. (US) 2007-01-04 WO disclosed
US-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity VICURON PHARMACEUTICALS INC. (US) 2006-09-21 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-20060211603-A1 Ramoplanin derivatives possessing antibacterial activity CLSPN, LMAN2, RPN2 CNR1 3561/4885CNR2 3256/4885HPGD 1825/4885

“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.