SCHEMBL19829017

SCHEMBL19829017

CCCCCc1ccc(-c2ccc(-c3ccc([N+]#N)cc3)cc2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B10 Q99714 3/20 0.57
▸ TSHR P16473 1/20 0.57
▸ RARB P10826 6/20 0.53
▸ ALDH1A1 P00352 4/20 0.51
▸ MEN1 O00255 2/20 0.51
▸ MAPT P10636 2/20 0.51
▸ KMT2A Q03164 2/20 0.51
▸ RARA P10276 1/20 0.51
▸ MTOR P42345 1/20 0.51
▸ HRH3 Q9Y5N1 1/20 0.49
▸ KDM4E B2RXH2 3/20 0.48
▸ ESR1 P03372 2/20 0.48
▸ ADRA2A P08913 2/20 0.48
▸ ADORA3 P0DMS8 2/20 0.48
▸ TACR2 P21452 2/20 0.48
▸ SLC6A2 P23975 2/20 0.48
▸ SLC6A4 P31645 2/20 0.48
▸ SLC6A3 Q01959 2/20 0.48
▸ LMNA P02545 1/20 0.48
▸ SHBG P04278 1/20 0.48

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
SCHEMBL6409299 0.94 ESR1 (0.53) HSD17B10TSHRRARBALDH1A1KDM4E
SCHEMBL6287956 0.92 ESR1 (0.57) HSD17B10TSHRALDH1A1KDM4EESR1
SCHEMBL114795 0.92 ESR1 (0.57) HSD17B10TSHRALDH1A1KDM4EESR1
SCHEMBL10820927 0.92 ESR1 (0.57) HSD17B10TSHRALDH1A1KDM4EESR1
SCHEMBL19829487 0.92 ESR1 (0.57) HSD17B10TSHRALDH1A1KDM4EESR1
SCHEMBL21539565 0.92 ESR1 (0.57) HSD17B10TSHRALDH1A1KDM4EESR1
Hydrochloric Acid SCHEMBL10821042 0.91 ESR1 (0.55) HSD17B10TSHRALDH1A1KDM4EESR1
Hydrochloric Acid SCHEMBL10935043 0.91 ESR1 (0.55) HSD17B10TSHRALDH1A1KDM4EESR1
Hydrochloric Acid SCHEMBL10820888 0.89 ESR1 (0.53) HSD17B10TSHRALDH1A1KDM4EESR1
Hydrochloric Acid SCHEMBL10820887 0.87 ESR1 (0.52) HSD17B10TSHRALDH1A1KDM4EESR1

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-20190085246-A1 REACTIVE PERPENDICULAR ALIGNED ORGANOSILICON MATERIAL AND MANUFACTURE METHOD OF LIQUID CRYSTAL DISPLAY PANEL SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2019-03-21 — — US disclosed
US-10167426-B2 Reactive perpendicular aligned organosilicon material and manufacture method of liquid crystal display panel SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2019-01-01 — — US disclosed
US-20180030353-A1 REACTIVE PERPENDICULAR ALIGNED ORGANOSILICON MATERIAL AND MANUFACTURE METHOD OF LIQUID CRYSTAL DISPLAY PANEL SHENZHEN CHINA STAR OPTOELECTRONICS TECHNOLOGY CO., LTD. (CN) 2018-02-01 — — 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-20180030353-A1 REACTIVE PERPENDICULAR ALIGNED ORGANOSILICON MATERIAL AND MANUFACTURE METHOD OF LIQUID CRYSTAL DISPLAY PANEL VCL, C1S, CFH HSD17B10 1159/4885TSHR 4651/4885RARB 4357/4885
US-20190085246-A1 REACTIVE PERPENDICULAR ALIGNED ORGANOSILICON MATERIAL AND MANUFACTURE METHOD OF LIQUID CRYSTAL DISPLAY PANEL SCO2, VCL, SHROOM3 HSD17B10 1262/4885TSHR 4650/4885RARB 4020/4885
US-10167426-B2 Reactive perpendicular aligned organosilicon material and manufacture method of liquid crystal display panel VCL, C1S, CFH HSD17B10 1159/4885TSHR 4651/4885RARB 4357/4885

“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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