SCHEMBL111461

SCHEMBL111461

Cc1ccc(/C=C/C(=O)Nc2ccccc2C)cc1C

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.75
MMP2 P08253 11/20 0.75
MMP9 P14780 11/20 0.75
EGFR P00533 1/20 0.73
KDM4E B2RXH2 2/20 0.64
RAB9A P51151 3/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
NPC1 O15118 2/20 0.57
MEN1 O00255 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 1/20 0.52
POLB P06746 1/20 0.52
KDM1A O60341 1/20 0.52
MAPK1 P28482 1/20 0.51
ALDH1A1 P00352 1/20 0.50
TP53 P04637 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
HPGD P15428 1/20 0.50

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
SCHEMBL111222 0.87 MMP1 (0.59) MMP1MMP2MMP9EGFR
SCHEMBL11648004 0.87 MMP1 (0.70) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL11655853 0.87 MMP1 (0.70) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL2779401 0.86 MEN1 (0.68) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL110012 0.86 MEN1 (0.68) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL13352117 0.85 MMP1 (0.67) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL111095 0.85 SMN1; SMN2 (0.74) MMP1MMP2MMP9EGFRKDM4E
SCHEMBL21024846 0.85 MMP1 (0.55) MMP1MMP2MMP9EGFRKDM4E
N-O-Tolylcinnamamide SCHEMBL2593754 0.84 MMP1 (1.00) MMP1MMP2MMP9EGFRKDM4E
N-O-Tolylcinnamamide SCHEMBL2593756 0.84 MMP1 (1.00) MMP1MMP2MMP9EGFRKDM4E

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
US-20180117050-A1 METHODS OF TREATING EYE DISEASES ASSOCIATED WITH INFLAMMATION AND VASCULAR PROLIFERATION OCCURX PTY LTD (AU) 2018-05-03 US disclosed
US-8624056-B2 Halogenated analogues of anti-fibrotic agents FIBROTECH THERAPEUTICS PTY LTD 2014-01-07 US disclosed
US-20120059188-A9 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS THE UNIVERSITY OF MELBOURNE (AU) 2012-03-08 US disclosed
US-20110021815-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2011-01-27 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 (3 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-20120059188-A9 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS MMP1, FIBP, HDGF MMP1 1/4885MMP2 104/4885MMP9 494/4885
US-20180117050-A1 METHODS OF TREATING EYE DISEASES ASSOCIATED WITH INFLAMMATION AND VASCULAR PROLIFERATION VCAM1, PTGIS, NFKBIA MMP1 10/4885MMP2 239/4885MMP9 205/4885
US-20110021815-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS MMP1, FIBP, HDGF MMP1 1/4885MMP2 104/4885MMP9 494/4885

“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.