SCHEMBL2512031

SCHEMBL2512031

CCCCN1Cc2cc(N(C)c3cnccc3-c3ccc(C(F)(F)F)cc3)ccc2C1=O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRF1 P14222 1/20 0.38
GPBAR1 Q8TDU6 8/20 0.36
HRH3 Q9Y5N1 1/20 0.36
GRM1 Q13255 2/20 0.36
GRM5 P41594 1/20 0.36
CACNA1B Q00975 2/20 0.35
DRD2 P14416 1/20 0.34
DRD5 P21918 1/20 0.34
DRD3 P35462 1/20 0.34
KLRK1 P26718 1/20 0.33
MICA Q29983 1/20 0.33
RAET1L Q5VY80 1/20 0.33
ROCK2 O75116 1/20 0.33
ROCK1 Q13464 1/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
HSD17B10 Q99714 1/20 0.33

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
SCHEMBL2514237 0.88 GRM5 (0.40) PRF1GPBAR1GRM1GRM5DRD2
SCHEMBL2511617 0.87 PRF1 (0.37) PRF1GPBAR1GRM1GRM5DRD2
SCHEMBL2511387 0.82 PRF1 (0.36) PRF1GRM1GRM5KDM4EALDH1A1
SCHEMBL2512032 0.79 GPBAR1 (0.38) PRF1GPBAR1HRH3GRM1GRM5
SCHEMBL2511391 0.77 GRM5 (0.38) PRF1GRM1GRM5
SCHEMBL2507288 0.77 GRM5 (0.38) PRF1GRM1GRM5ALDH1A1
SCHEMBL2509717 0.75 KDM4C (0.38) GRM1GRM5KDM4EALDH1A1
SCHEMBL2511458 0.73 GRM1 (0.36) PRF1GRM1GRM5DRD2DRD5
SCHEMBL2506683 0.72 GRM5 (0.41) PRF1HRH3GRM1GRM5DRD2
SCHEMBL2511620 0.68 CRBN (0.37) PRF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8664214-B2 Small molecule potentiators of metabotropic glutamate receptors I AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-04 US claimed
US-8664214-B2 Small molecule potentiators of metabotropic glutamate receptors I AbbVie Deutschland GmbH & Co. KG (DE) 2014-03-04 US disclosed
US-20110245232-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS I ABBOTT GMBH & CO. KG (DE) 2011-10-06 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-20110245232-A1 NOVEL SMALL MOLECULE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS I GRM3, GRIN2C, GRIN2B PRF1 4454/4885GPBAR1 118/4885HRH3 184/4885

“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.