SCHEMBL1822751

SCHEMBL1822751

ON1CCC(c2cc(F)cc(Cl)c2)C1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPM5 Q9NZQ8 7/20 0.36
TRPM4 Q8TD43 2/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
SPR P35270 2/20 0.33
RIPK1 Q13546 2/20 0.33
FFAR4 Q5NUL3 1/20 0.33
HSD11B1 P28845 1/20 0.33
ACHE P22303 1/20 0.32
ATM Q13315 1/20 0.32
NPY5R Q15761 1/20 0.32
GRM4 Q14833 1/20 0.31

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
SCHEMBL3014454 0.88 RAB9A (0.41) NPC1RAB9ASMN1; SMN2ATMNPY5R
SCHEMBL1822725 0.88 NOTUM (0.38) NPC1RAB9ASMN1; SMN2SPRHSD11B1
SCHEMBL1822634 0.81 SLC6A2 (0.43)
SCHEMBL15516297 0.77 TRPM5 (0.38) TRPM5TRPM4RIPK1FFAR4NPY5R
SCHEMBL1822924 0.76 SLC6A2 (0.44)
SCHEMBL1823936 0.73 USP30 (0.42)
SCHEMBL15517235 0.73 GRM4 (0.36) TRPM5TRPM4RIPK1FFAR4NPY5R
SCHEMBL1820929 0.73 SLC6A2 (0.42) RIPK1
SCHEMBL22415970 0.73 DRD2 (0.40)
SCHEMBL3633982 0.70 GRM2 (0.35) NPC1RAB9ASMN1; SMN2SPRHSD11B1

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
EP-2155669-B1 NEW DISUBSTITUTED PHENYLPYRROLIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB AF NEUROSEARCH SWEDEN AB (DK) 2011-05-04 EP disclosed
US-20100197760-A1 DISUBSTITUTED PHENYLPYRROLIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB, FILIAL AF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2010-08-05 US disclosed
EP-2155669-A1 NEW DISUBSTITUTED PHENYLPYRROLIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB, Filial af NeuroSearch Sweden AB, Sverige (DK) 2010-02-24 EP disclosed
WO-2008148799-A1 NEW DISUBSTITUTED PHENYLPYRROLIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION NSAB, FILIAL OF NEUROSEARCH SWEDEN AB, SVERIGE (DK) 2008-12-11 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 (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-20100197760-A1 DISUBSTITUTED PHENYLPYRROLIDINES AS MODULATORS OF CORTICAL CATECHOLAMINERGIC NEUROTRANSMISSION SLC6A2, SLC6A3, SLC18A2 TRPM5 479/4885TRPM4 545/4885NPC1 1701/4885

“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.