SCHEMBL13744713

SCHEMBL13744713

COc1cccc2c(NC(=O)C3CCN(C(C)C)CC3)c(C(=O)Nc3ccc(Cl)cn3)oc12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 6/20 0.57
▸ RXFP1 Q9HBX9 2/20 0.43
▸ SMN1; SMN2 Q16637 3/20 0.42
▸ MEN1 O00255 6/20 0.42
▸ KMT2A Q03164 6/20 0.42
▸ HSD17B10 Q99714 3/20 0.41
▸ MAPT P10636 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ DHODH Q02127 1/20 0.41
▸ NPSR1 Q6W5P4 1/20 0.41
▸ F2 P00734 1/20 0.41
▸ RAB9A P51151 4/20 0.40
▸ NPC1 O15118 3/20 0.40
▸ MAPK1 P28482 1/20 0.40
▸ TP53 P04637 3/20 0.40
▸ MALT1 Q9UDY8 1/20 0.40
▸ ALOX15 P16050 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39

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
SCHEMBL13744526 0.90 F10 (0.60) F10SMN1; SMN2MEN1KMT2AMAPT
SCHEMBL13744466 0.86 KMT2A (0.44) F10RXFP1SMN1; SMN2MEN1KMT2A
SCHEMBL2941238 0.85 F10 (0.62) F10RXFP1SMN1; SMN2MEN1KMT2A
Hydrochloric Acid SCHEMBL6107245 0.84 F10 (0.67) F10RXFP1SMN1; SMN2MEN1KMT2A
SCHEMBL13744525 0.83 F10 (0.59) F10SMN1; SMN2MEN1KMT2AHSD17B10
SCHEMBL13290428 0.80 F10 (0.61) F10SMN1; SMN2TSHRLMNAF2
SCHEMBL13744314 0.78 F10 (0.46) F10SMN1; SMN2F2RAB9ANPC1
Hydrochloric Acid SCHEMBL6107312 0.78 F10 (0.74) F10SMN1; SMN2KMT2ATSHRLMNA
SCHEMBL13206713 0.77 F10 (0.80) F10SMN1; SMN2KMT2ATSHRLMNA
SCHEMBL13744708 0.76 F10 (0.57) F10SMN1; SMN2HSD17B10TSHRLMNA

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-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 — — US disclosed
US-20090209511-A1 Benzofuran Derivatives KAWAGUCHI TAKAYUKI 2009-08-20 — — US disclosed
US-7531537-B2 Benzofuran derivative MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-05-12 — — 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-20090209511-A1 Benzofuran Derivatives F12, F2, F3 F10 5/4885RXFP1 1004/4885SMN1; SMN2 3067/4885

“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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