SCHEMBL5923485

SCHEMBL5923485

Cc1cccc(NC(=N)NCCc2ccc(Oc3ccccc3)cc2)n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 4/20 0.58
▸ LMNA P02545 3/20 0.58
▸ ALDH1A1 P00352 2/20 0.58
▸ GRM5 P41594 1/20 0.55
▸ KMT2A Q03164 3/20 0.54
▸ SMN1; SMN2 Q16637 3/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ PLA2G1B P04054 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ NPSR1 Q6W5P4 1/20 0.54
▸ ATG4B Q9Y4P1 1/20 0.54
▸ EPHX2 P34913 4/20 0.48
▸ HSD17B10 Q99714 2/20 0.46
▸ HPGD P15428 1/20 0.46
▸ PLAAT3 P53816 2/20 0.44
▸ PLAAT5 Q96KN8 2/20 0.44
▸ PLAAT2 Q9NWW9 2/20 0.44
▸ PLAAT4 Q9UL19 2/20 0.44
▸ GBA1 P04062 1/20 0.44
▸ LTA4H P09960 3/20 0.43

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
SCHEMBL5923332 0.86 EPHX2 (0.49) KDM4ELMNAALDH1A1GRM5KMT2A
SCHEMBL5923376 0.82 EPHX2 (0.49) KDM4ELMNAALDH1A1EPHX2PLAAT3
SCHEMBL5923299 0.82 EPHX2 (0.46) KDM4ELMNAALDH1A1EPHX2PLAAT3
SCHEMBL5922903 0.80 KMT2A (0.72) KDM4ELMNAALDH1A1GRM5KMT2A
SCHEMBL5923241 0.80 EPHX2 (0.49) KDM4ELMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL5923119 0.77 HTT (0.48) LMNAALDH1A1SMN1; SMN2ALOX12EPHX2
SCHEMBL5923285 0.76 EPHX2 (0.46) LMNAALDH1A1KMT2ASMN1; SMN2MEN1
SCHEMBL5923374 0.76 EPHX2 (0.45) LMNAALDH1A1KMT2AALOX12EPHX2
SCHEMBL5923312 0.76 MEN1 (0.58) KDM4ELMNAALDH1A1GRM5KMT2A
SCHEMBL5923434 0.74 KMT2A (0.61) KDM4ELMNAALDH1A1GRM5KMT2A

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-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2006-05-11 — — US claimed
US-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication ACHILLION PHARMACEUTICALS, INC. 2006-05-11 — — 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-20060100225-A1 Heteroaryl guanidines; inhibitors of viral replication PIGS, GUCY1A1, GUCY1B1 KDM4E 1667/4885LMNA 620/4885ALDH1A1 535/4885

“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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