SCHEMBL17356249

SCHEMBL17356249

c1ccc(-c2ccc3c(c2)sc2cc4ccc(-c5ccc6cc7sc8cc(-c9ccccc9)ccc8c7cc6c5)cc4cc23)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.46
ESR2 Q92731 4/20 0.46
F9 P00740 2/20 0.43
PIK3CA P42336 1/20 0.42
PI4KA P42356 1/20 0.42
PI4KB Q9UBF8 1/20 0.42
LIMK1 P53667 1/20 0.42
GRIN2D O15399 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
BACE1 P56817 1/20 0.38
GPR84 Q9NQS5 1/20 0.37
HSD17B1 P14061 2/20 0.37
HSD17B2 P37059 2/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
HPGD P15428 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37

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
SCHEMBL17356256 1.00 ESR1 (0.46) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL17356248 1.00 ESR1 (0.46) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL17356253 0.95 ESR1 (0.50) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL17356250 0.95 ESR1 (0.50) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL15223460 0.95 ESR1 (0.50) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL18352180 0.95 ESR1 (0.50) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL16024693 0.93 ESR1 (0.48) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL16024692 0.93 ESR1 (0.48) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL15223465 0.93 ESR1 (0.48) ESR1ESR2F9PIK3CAPI4KA
SCHEMBL20342355 0.93 ESR1 (0.48) ESR1ESR2F9PIK3CAPI4KA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9985222-B2 Organic compound, and organic thin film and electronic device SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-29 US disclosed
US-9985222-B2 Organic compound, and organic thin film and electronic device SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-05-29 US disclosed
US-20150372241-A1 ORGANIC COMPOUND, AND ORGANIC THIN FILM AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-24 US disclosed
US-20150372241-A1 ORGANIC COMPOUND, AND ORGANIC THIN FILM AND ELECTRONIC DEVICE SAMSUNG ELECTRONICS CO., LTD. (KR) 2015-12-24 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-20150372241-A1 ORGANIC COMPOUND, AND ORGANIC THIN FILM AND ELECTRONIC DEVICE OCIAD1, POU2F1, SLCO2A1 ESR1 107/4885ESR2 619/4885F9 471/4885

“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.