SCHEMBL19466204

SCHEMBL19466204

CCOc1cc(O)ncc1C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 1/20 0.38
▸ AOC3 Q16853 2/20 0.37
▸ TSHR P16473 3/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.36
▸ MEN1 O00255 3/20 0.35
▸ KMT2A Q03164 3/20 0.35
▸ TLR8 Q9NR97 1/20 0.35
▸ SLC6A2 P23975 1/20 0.35
▸ SLC6A4 P31645 1/20 0.35
▸ SLC6A3 Q01959 1/20 0.35
▸ KDM4E B2RXH2 4/20 0.34
▸ MAPT P10636 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ GAA P10253 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ ALPL P05186 1/20 0.34
▸ HTT P42858 1/20 0.34

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
SCHEMBL16046415 0.78 AOC3 (0.36) AOC3TSHRCYP3A4ALDH1A1MEN1
SCHEMBL13765676 0.78 GABRP (0.40) AOC3TSHRCYP3A4ALDH1A1MEN1
SCHEMBL9784641 0.77 S1PR1 (0.41) ESR1AOC3TSHRCYP3A4SLC6A2
SCHEMBL25004559 0.76 HPGD (0.39) AOC3TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL22978677 0.73 AOC3 (0.35) AOC3TSHRCYP3A4ALDH1A1MEN1
SCHEMBL13324326 0.73 KDM4E (0.49) ESR1TSHRCYP3A4ALDH1A1MEN1
SCHEMBL4594918 0.72 MAPT (0.46) ALDH1A1MEN1KMT2AMAPTGAA
Hydrochloric Acid SCHEMBL9784650 0.72 KDM4E (0.39) AOC3TSHRCYP3A4ALDH1A1MEN1
SCHEMBL13696443 0.72 NPSR1 (0.39) AOC3ALDH1A1HPGDALPLMAPK1
SCHEMBL9704738 0.71 ESR1 (0.51) ESR1TSHRCYP3A4ALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3191449-B1 COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS GLAXOSMITHKLINE IP DEV LTD (GB) 2020-07-01 — — EP disclosed
US-10294236-B2 Compounds as rearranged during transfection (RET) inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2019-05-21 — — US disclosed
US-20180099976-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-04-12 — — US disclosed
US-9879021-B2 Compounds as rearranged during transfection (RET) inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2018-01-30 — — US disclosed
US-20170298074-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-19 — — US disclosed
US-9789100-B2 Compounds as rearranged during transfection (RET) inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2017-10-17 — — 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 (3 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-10294236-B2 Compounds as rearranged during transfection (RET) inhibitors RET, FER, THRB ESR1 2827/4885AOC3 3910/4885TSHR 8/4885
US-20170298074-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS RET, FER, THRB ESR1 3017/4885AOC3 4171/4885TSHR 8/4885
US-20180099976-A1 NOVEL COMPOUNDS AS REARRANGED DURING TRANSFECTION (RET) INHIBITORS RET, FER, THRB ESR1 3017/4885AOC3 4171/4885TSHR 8/4885

“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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