SCHEMBL19880347

SCHEMBL19880347

Oc1ccc(C2(c3ccc(O)c(I)c3)c3ccccc3-c3ccccc32)cc1I

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 2/20 0.65
▸ ESR2 Q92731 2/20 0.65
▸ DHFR P00374 3/20 0.49
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ LMNA P02545 4/20 0.47
▸ MAPT P10636 4/20 0.47
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ KDM4E B2RXH2 1/20 0.47
▸ OPRK1 P41145 1/20 0.47
▸ TDP1 Q9NUW8 5/20 0.38
▸ L3MBTL1 Q9Y468 3/20 0.38
▸ POLB P06746 2/20 0.38
▸ NPSR1 Q6W5P4 2/20 0.38
▸ XBP1 P17861 1/20 0.38
▸ CXCR1 P25024 1/20 0.38
▸ AVPR2 P30518 1/20 0.38
▸ CCR4 P51679 1/20 0.38
▸ APP P05067 1/20 0.34
▸ PDK2 Q15119 3/20 0.33

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
SCHEMBL29375514 0.83 ESR1 (0.71) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL1324119 0.83 ESR1 (0.71) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL18855333 0.81 ESR1 (0.54) ESR1ESR2DHFRMEN1KMT2A
SCHEMBL31296636 0.79 ESR1 (0.65) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL1482551 0.79 ESR1 (0.65) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL70957 0.79 ESR1 (1.00) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL31220287 0.79 ESR1 (0.65) ESR1ESR2MEN1KMT2ALMNA
SCHEMBL217779 0.79 ESR1 (0.65) ESR1ESR2DHFRMEN1KMT2A
SCHEMBL29850833 0.79 ESR2 (0.65) ESR1ESR2DHFRMEN1KMT2A
SCHEMBL2832176 0.79 ESR1 (0.65) ESR1ESR2DHFRMEN1KMT2A

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-11214583-B2 Compound having alkoxysilyl group and active ester group, method for preparing same, composition comprising same, and use KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2022-01-04 — — US disclosed
US-20200165275-A1 COMPOUND HAVING ALKOXYSILYL GROUP AND ACTIVE ESTER GROUP, METHOD FOR PREPARING SAME, COMPOSITION COMPRISING SAME, AND USE KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2020-05-28 — — US disclosed
US-9896535-B2 Epoxy compound having alkoxysilyl group, method of preparing the same, composition and cured product comprising the same, and uses thereof KOREA INSTITUTE OF INDUSTRIAL TECHNOLOGY (KR) 2018-02-20 — — 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 (2 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-20200165275-A1 COMPOUND HAVING ALKOXYSILYL GROUP AND ACTIVE ESTER GROUP, METHOD FOR PREPARING SAME, COMPOSITION COMPRISING SAME, AND USE NOTUM, AGPS, ESD ESR1 1248/4885ESR2 2607/4885DHFR 1473/4885
US-11214583-B2 Compound having alkoxysilyl group and active ester group, method for preparing same, composition comprising same, and use NOTUM, AGPS, ESD ESR1 1248/4885ESR2 2607/4885DHFR 1473/4885

“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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