SCHEMBL12711343

SCHEMBL12711343

Cc1ccc(-c2ccc(-c3cc4c(s3)-c3c(C)c5c(c(C)c3C4)-c3sc(-c4ccc(-c6ccc(C)s6)s4)cc3C5)s2)s1

nearest known ligand 0.31

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ GFER P55789 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL12711280 0.98 KDR (0.32) KDRNPC1ALDH1A1MAPTGFER
SCHEMBL12711508 0.96 — —
SCHEMBL12711392 0.82 HSD17B1 (0.32) —
SCHEMBL12711305 0.78 — —
SCHEMBL12711352 0.78 KDR (0.32) KDRNPC1ALDH1A1MAPTGFER
SCHEMBL12711271 0.76 NOS3 (0.33) —
SCHEMBL12711276 0.76 KDR (0.33) KDRNPC1ALDH1A1MAPTGFER
SCHEMBL12711506 0.74 KDR (0.31) KDR
SCHEMBL12711315 0.74 CYP2A6 (0.38) —
SCHEMBL16546089 0.72 KDR (0.33) KDRNPC1ALDH1A1MAPTGFER

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-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 — — US disclosed
US-20110087034-A1 Organic Semiconductor Material SUMITOMO CHEMICAL COMPANY LIMITED (JP) 2011-04-14 — — 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-20110087034-A1 Organic Semiconductor Material OR10J3, TST, OR51E2 KDR 699/4885NPC1 3543/4885ALDH1A1 137/4885

“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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