SCHEMBL21335618

SCHEMBL21335618

Cc1ccc(C2(c3ccc(C)cc3)c3cc4c(cc3-c3ccc5sc(C)cc5c32)C(c2ccc(C)cc2)(c2ccc(C)cc2)c2c-4ccc3sc(C)cc23)cc1

nearest known ligand 0.31

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31
ICAM1 P05362 1/20 0.30
SELE P16581 1/20 0.30
VCAM1 P19320 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
SCHEMBL20040188 0.91 ICAM1 (0.32) ICAM1SELEVCAM1
SCHEMBL21335628 0.84
SCHEMBL21335614 0.80 ALDH1A1 (0.31) ALDH1A1
SCHEMBL20040201 0.80 BTK (0.31) ALDH1A1
SCHEMBL21335706 0.77
SCHEMBL21335635 0.75
SCHEMBL20040205 0.74
SCHEMBL17807418 0.74
SCHEMBL21335703 0.73 HDAC3 (0.30)
SCHEMBL20040150 0.73

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10411190-B2 Organic semiconducting compounds MERCK PATENT GMBH (DE) 2019-09-10 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-10411190-B2 Organic semiconducting compounds OCIAD2, OCIAD1, OSTC ALDH1A1 2427/4885ICAM1 1259/4885SELE 215/4885

“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.