SCHEMBL6100516

SCHEMBL6100516

O=C(/C=C/c1ccccc1)Nc1ccccc1C(=O)Nc1ccccc1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.74
RECQL P46063 1/20 0.74
MMP1 P03956 10/20 0.69
MMP2 P08253 10/20 0.69
MMP9 P14780 10/20 0.69
EGFR P00533 6/20 0.69
MAOA P21397 1/20 0.69
MAOB P27338 1/20 0.69
NR1H4 Q96RI1 1/20 0.63
TRPM2 O94759 1/20 0.62
LTB4R Q15722 1/20 0.62
DEGS1 O15121 1/20 0.61
TRPA1 O75762 5/20 0.60
TRPM8 Q7Z2W7 2/20 0.60
MEN1 O00255 1/20 0.56
NPC1 O15118 1/20 0.56
MAPT P10636 1/20 0.56
RAB9A P51151 1/20 0.56
KMT2A Q03164 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56

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
SCHEMBL6100523 1.00 HTT (0.74) HTTRECQLMMP1MMP2MMP9
SCHEMBL6097501 0.86 KMT2A (0.72) HTTRECQLMMP1MMP2MMP9
SCHEMBL28605928 0.85 MMP1 (0.64) MMP1MMP2MMP9EGFRNR1H4
SCHEMBL28605929 0.85 MMP1 (0.64) MMP1MMP2MMP9EGFRNR1H4
SCHEMBL294403 0.84 TRPM2 (0.83) RECQLMMP1MMP2MMP9EGFR
SCHEMBL294402 0.84 TRPM2 (0.83) RECQLMMP1MMP2MMP9EGFR
N-Phenylcinnamamide SCHEMBL3667414 0.82 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOA
N-Phenylcinnamamide SCHEMBL4205896 0.82 MMP1 (1.00) MMP1MMP2MMP9EGFRMAOA
SCHEMBL10492424 0.82 MMP1 (0.80) MMP1MMP2MMP9EGFRMAOA
SCHEMBL10492426 0.82 MMP1 (0.80) MMP1MMP2MMP9EGFRMAOA

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-7053216-B2 Modulators of Rho C activity ICONIX PHARMACEUTICALS, INC. (US) 2006-05-30 US disclosed
US-20030171387-A1 Modulators of Rho C activity ENTELOS HOLDING CORP. 2003-09-11 US disclosed
WO-2003043961-A2 MODULATORS OF RHO C ACTIVITY ICONIX PHARMACEUTICALS, INC. (US) 2003-05-30 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-20030171387-A1 Modulators of Rho C activity RHOC, ROCK1, CIT HTT 3522/4885RECQL 479/4885MMP1 2062/4885

“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.