SCHEMBL21156754

SCHEMBL21156754

Ic1ccc(-c2ccc(-c3ccc(-c4ccc(I)s4)s3)s2)s1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
APP P05067 2/20 0.33
ESR1 P03372 1/20 0.33
ESR2 Q92731 1/20 0.33
KDM4E B2RXH2 1/20 0.31
NPC1 O15118 1/20 0.31
GLA P06280 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 1/20 0.31

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
SCHEMBL2590561 0.97
SCHEMBL7586949 0.83 HSD17B1 (0.50) APPESR1ESR2KDM4ENPC1
SCHEMBL15243106 0.83 APP (0.44) APPESR1ESR2
SCHEMBL498630 0.81 DPP4 (0.53) KDM4ENPC1GLAMAPTRAB9A
SCHEMBL7590473 0.79 RAB9A (0.48) APPESR1ESR2KDM4ENPC1
SCHEMBL357574 0.78
SCHEMBL2592381 0.75 DPP4 (0.53) APPKDM4EMAPT
SCHEMBL12293440 0.65
SCHEMBL2855363 0.65
SCHEMBL19089756 0.65

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-20190214581-A1 ORGANIC SEMICONDUCTING COMPOUNDS MERCK PATENT GMBH (DE) 2019-07-11 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-20190214581-A1 ORGANIC SEMICONDUCTING COMPOUNDS OCIAD2, OCIAD1, EED APP 1855/4885ESR1 1176/4885ESR2 2706/4885

“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.