SCHEMBL10299504

SCHEMBL10299504

COc1cccc(-c2cnc(NC(=O)/C=C/c3ccccc3)nc2)c1OC

nearest known ligand 0.55

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ MMP1 P03956 5/20 0.55
▸ MMP2 P08253 5/20 0.55
▸ MMP9 P14780 5/20 0.55
▸ EGFR P00533 3/20 0.55
▸ NPC1 O15118 3/20 0.53
▸ RAB9A P51151 3/20 0.53
▸ LTB4R Q15722 2/20 0.49
▸ MAPT P10636 2/20 0.47
▸ SMN1; SMN2 Q16637 4/20 0.47
▸ BCHE P06276 1/20 0.46
▸ IMPDH2 P12268 1/20 0.46
▸ KMT2A Q03164 4/20 0.45
▸ LMNA P02545 2/20 0.45
▸ MEN1 O00255 2/20 0.44
▸ TRPV1 Q8NER1 1/20 0.44
▸ STAT1 P42224 1/20 0.44
▸ MITF O75030 1/20 0.44
▸ HTT P42858 1/20 0.44
▸ MDM2 Q00987 1/20 0.44

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
SCHEMBL10008854 1.00 MMP1 (0.55) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10008857 1.00 MMP1 (0.55) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10299116 0.89 MMP1 (0.55) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10009481 0.77 MMP1 (0.57) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10009478 0.77 MMP1 (0.57) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10008771 0.76 RAB9A (0.49) RAB9ALTB4RMAPTSMN1; SMN2KMT2A
SCHEMBL10008580 0.74 KMT2A (0.61) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10008577 0.74 KMT2A (0.61) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10010523 0.74 EGFR (0.62) MMP1MMP2MMP9EGFRNPC1
SCHEMBL10299114 0.74 EGFR (0.62) MMP1MMP2MMP9EGFRNPC1

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-8883793-B2 Tubulin inhibitors and methods of using the same DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2014-11-11 — — US disclosed
US-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME DEVELOPMENT CENTER FOR BIOTECHNOLOGY (TW) 2012-07-05 — — 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-20120172374-A1 NOVEL TUBULIN INHIBITORS AND METHODS OF USING THE SAME TUBB1, TUBA1C, TUBB MMP1 2605/4885MMP2 3553/4885MMP9 4303/4885

“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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