SCHEMBL14130337

SCHEMBL14130337

C[C@@H]1CN(C(=O)c2ccc(OCC(F)(F)F)cc2Cl)c2ccccc2CN1C(=O)NCC(=O)N1CCCC1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AVPR2 P30518 15/20 0.39
CACNA1G O43497 1/20 0.38
CACNA1H O95180 1/20 0.38
CACNA1I Q9P0X4 1/20 0.38
HCRTR1 O43613 2/20 0.37
HCRTR2 O43614 2/20 0.37
POLB P06746 1/20 0.36
AVPR1A P37288 3/20 0.36
OXTR P30559 1/20 0.35

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
SCHEMBL14130473 0.95 CACNA1G (0.37) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130166 0.94 AVPR2 (0.37) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL5063405 0.94 CACNA1G (0.36) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130311 0.92 LIPE (0.38) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130472 0.92 HCRTR1 (0.37) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130073 0.92 HCRTR1 (0.37) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130443 0.90 CACNA1G (0.42) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130325 0.90 CACNA1G (0.41) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1
SCHEMBL14130286 0.90 AVPR2 (0.39) AVPR2CACNA1GCACNA1HCACNA1IPOLB
SCHEMBL14130517 0.90 CACNA1G (0.40) AVPR2CACNA1GCACNA1HCACNA1IHCRTR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 US disclosed
US-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these KISSEI PHARMACEUTICAL CO., LTD. (JP) 2008-07-03 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-20080161294-A1 Urea derivative, medicinal composition containing the same, and medicinal use of these AVPR2, UTS2R, GPR119 AVPR2 1/4885CACNA1G 3324/4885CACNA1H 3214/4885

“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.