SCHEMBL4378410

SCHEMBL4378410

CN(CCN)c1ccc(Br)cc1

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TAAR1 Q96RJ0 2/20 0.42
▸ HTR2A P28223 1/20 0.41
▸ CARM1 Q86X55 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35
▸ PRMT8 Q9NR22 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ KDM1A O60341 1/20 0.35
▸ PYCR1 P32322 1/20 0.34
▸ NOS1 P29475 1/20 0.33
▸ NOS2 P35228 1/20 0.33
▸ ALOX15 P16050 1/20 0.33
▸ MAPK1 P28482 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
SCHEMBL12403449 0.83 APP (0.44) TAAR1ALDH1A1KDM4ECYP2A6KDM1A
SCHEMBL7186148 0.80 ALDH1A1 (0.48) TAAR1CARM1PRMT6PRMT8ALDH1A1
SCHEMBL21115197 0.80 TAAR1 (0.54) TAAR1HTR2AALDH1A1KDM4ECYP2A6
SCHEMBL1432529 0.80 TAAR1 (0.43) TAAR1ALDH1A1KDM4ECYP2A6KDM1A
SCHEMBL5853973 0.78 L3MBTL1 (0.46) TAAR1ALDH1A1KDM4ECYP2A6
SCHEMBL19994722 0.78 TAAR1 (0.42) TAAR1ALDH1A1KDM4ECYP2A6KDM1A
SCHEMBL22542480 0.78 TAAR1 (0.41) TAAR1CARM1PRMT6PRMT8ALDH1A1
SCHEMBL5188252 0.78 AOC3 (0.44) TAAR1HTR2ACARM1ALDH1A1KDM4E
SCHEMBL29426388 0.78 APP (0.41) CARM1PRMT6PRMT8PYCR1NOS1
SCHEMBL4395973 0.77 CARM1 (0.52) TAAR1CARM1PRMT6PRMT8NOS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7625932-B2 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY (US) 2009-12-01 — — US disclosed
EP-1670757-B1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS LILLY CO ELI (US) 2009-05-06 — — EP disclosed
US-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors ELI LILLY AND COMPANY 2007-03-22 — — US disclosed
EP-1670757-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2006-06-21 — — EP disclosed
WO-2005040110-A1 PYRROLE AND PYRAZOLE DERIVATIVES AS POTENTIATORS OF GLUTAMATE RECEPTORS ELI LILLY AND COMPANY (US) 2005-05-06 — — 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-20070066573-A1 Pyrrole and pyrazole derivatives as potentiators of glutamate receptors GRIN1, GRIN3A, GRIK5 TAAR1 373/4885HTR2A 1007/4885CARM1 1668/4885

“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.

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