SCHEMBL5180712

SCHEMBL5180712

N=C(N)NN=CCc1cccn1-c1ccc(-n2cccc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ AOC2 O75106 3/20 0.35
▸ VHL P40337 1/20 0.33
▸ ELOC Q15369 1/20 0.33
▸ ELOB Q15370 1/20 0.33
▸ POLB P06746 4/20 0.33
▸ MAPT P10636 4/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ ALDH1A1 P00352 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ RAB9A P51151 3/20 0.32
▸ LMNA P02545 1/20 0.32
▸ LTA4H P09960 1/20 0.31
▸ NSD2 O96028 1/20 0.31
▸ GRK2 P25098 1/20 0.31
▸ CASP6 P55212 1/20 0.31
▸ CTDSP1 Q9GZU7 1/20 0.31
▸ TSHR P16473 1/20 0.30

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
SCHEMBL5180710 1.00 AOC2 (0.35) AOC2VHLELOCELOBPOLB
SCHEMBL4179681 0.77 KDM4E (0.39) POLBMAPTALDH1A1KDM4ERAB9A
SCHEMBL4179685 0.77 KDM4E (0.39) POLBMAPTALDH1A1KDM4ERAB9A
SCHEMBL12123975 0.75 LMNA (0.35) AOC2VHLELOCELOBPOLB
SCHEMBL5180033 0.75 ALDH1A1 (0.34) ALDH1A1KDM4ELMNA
SCHEMBL5180028 0.75 ALDH1A1 (0.34) ALDH1A1KDM4ELMNA
SCHEMBL4186688 0.71 VHL (0.39) AOC2VHLELOCELOBPOLB
SCHEMBL5180770 0.67 KDM4E (0.34) KDM4E
SCHEMBL5180767 0.67 KDM4E (0.34) KDM4E
SCHEMBL4179666 0.66 L3MBTL1 (0.49) POLBMAPTMEN1KMT2AALDH1A1

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-1414440-B1 N-PHENYLPYRROLE GUANIDINE DERIVATIVES AS MELANOCORTIN RECEPTOR LIGANDS ACTION PHARMA AS (DK) 2007-01-10 — — EP claimed
US-20060148798-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands ACTION PHARMA A/S (DK) 2006-07-06 — — US claimed
EP-1414440-B1 N-PHENYLPYRROLE GUANIDINE DERIVATIVES AS MELANOCORTIN RECEPTOR LIGANDS ACTION PHARMA AS (DK) 2007-01-10 — — EP disclosed
US-20060148798-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands ACTION PHARMA A/S (DK) 2006-07-06 — — 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-20060148798-A1 N-phenylpyrrole guanidine derivatives as melanocortin receptor ligands MC1R, MC5R, MC3R AOC2 1158/4885VHL 1931/4885ELOC 3614/4885

“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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