SCHEMBL19807223

SCHEMBL19807223

CC(C)(C)/C=C1\C(=O)c2ccccc2C1=C(C#N)C#N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.39
▸ KMT2A Q03164 8/20 0.39
▸ ALDH1A1 P00352 7/20 0.39
▸ MEN1 O00255 5/20 0.39
▸ HTT P42858 3/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ RAB9A P51151 3/20 0.39
▸ HPGD P15428 3/20 0.39
▸ MAPK1 P28482 2/20 0.39
▸ THRB P10828 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ LMNA P02545 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ ATM Q13315 1/20 0.39
▸ HKDC1 Q2TB90 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ PKM P14618 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ POLB P06746 1/20 0.36

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
SCHEMBL22108873 0.89 ALDH1A1 (0.34) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL16977316 0.83 S100A4 (0.42) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL2681524 0.83 S100A4 (0.42) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL2681526 0.83 S100A4 (0.42) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL13679336 0.82 MAPT (0.40) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL22544872 0.81 S100A4 (0.41) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL25759327 0.80 KMT2A (0.39) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL1104969 0.80 KMT2A (0.39) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL20365624 0.80 TDP2 (0.42) MAPTKMT2AALDH1A1MEN1HTT
SCHEMBL20365626 0.80 TDP2 (0.42) MAPTKMT2AALDH1A1MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11158818-B2 Compound and organic solar cell comprising same LG CHEM, LTD. 2021-10-26 — — US disclosed
US-20210323974-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE INCLUDING SAME LG CHEM, LTD. (KR) 2021-10-21 — — US disclosed
US-20210284902-A1 ELECTROCHROMIC COMPOSITE, ELECTROCHROMIC ELEMENT COMPRISING SAME, AND MANUFACTURING METHOD FOR ELECTROCHROMIC ELEMENT LG CHEM, LTD. (KR) 2021-09-16 — — US disclosed
US-11094890-B2 Organic transistor LG CHEM, LTD. 2021-08-17 — — US disclosed
US-11038114-B2 Method for manufacturing organic solar cell and organic solar cell manufactured by using the same LG CHEM, LTD. 2021-06-15 — — US disclosed
US-20210135120-A1 METHOD FOR MANUFACTURING ORGANIC SOLAR CELL AND ORGANIC SOLAR CELL MANUFACTURED BY USING THE SAME LG CHEM, LTD. (KR) 2021-05-06 — — US disclosed
US-10906922-B2 Heterocyclic compound and organic solar cell comprising same LG CHEM, LTD. (KR) 2021-02-02 — — US disclosed
US-20200301230-A1 ELECTROCHROMIC DEVICE COMPRISING ELECTROCHROMIC COMPOUND AND MANUFACTURING METHOD THEREFOR LG CHEM, LTD. (KR) 2020-09-24 — — US disclosed
US-10734131-B2 Organic transistor and gas sensor LG CHEM, LTD. (KR) 2020-08-04 — — US disclosed
US-10693081-B2 Heterocyclic compound and organic solar cell comprising same LG CHEM, LTD. (KR) 2020-06-23 — — US disclosed
US-20200066992-A1 PHOTOACTIVE LAYER AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEM, LTD. (KR) 2020-02-27 — — US disclosed
US-10355221-B2 Heterocyclic compound and organic solar cell comprising the same LG CHEM, LTD. (KR) 2019-07-16 — — US disclosed
US-20180057515-A1 HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEM, LTD. (KR) 2018-03-01 — — US disclosed
US-20180026200-A1 HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME LG CHEM, LTD. (KR) 2018-01-25 — — 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 (9 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-10734131-B2 Organic transistor and gas sensor OR10J3, OSBPL8, TPR MAPT 1345/4885KMT2A 984/4885ALDH1A1 3521/4885
US-11158818-B2 Compound and organic solar cell comprising same CRY1, OR10J3, PROX1 MAPT 1986/4885KMT2A 794/4885ALDH1A1 624/4885
US-10355221-B2 Heterocyclic compound and organic solar cell comprising the same SUN2, CRY1, STOM MAPT 2108/4885KMT2A 378/4885ALDH1A1 1187/4885
US-20180026200-A1 HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME SUN2, CRY1, STOM MAPT 2206/4885KMT2A 432/4885ALDH1A1 1159/4885
US-10693081-B2 Heterocyclic compound and organic solar cell comprising same SUN2, CRY1, STOM MAPT 2206/4885KMT2A 432/4885ALDH1A1 1159/4885
US-10906922-B2 Heterocyclic compound and organic solar cell comprising same SUN2, CRY1, STOM MAPT 2206/4885KMT2A 432/4885ALDH1A1 1159/4885
US-20180057515-A1 HETEROCYCLIC COMPOUND AND ORGANIC SOLAR CELL COMPRISING SAME SUN2, CRY1, STOM MAPT 2206/4885KMT2A 432/4885ALDH1A1 1159/4885
US-20210323974-A1 HETEROCYCLIC COMPOUND AND ORGANIC ELECTRONIC DEVICE INCLUDING SAME ODC1, AOX1, CYP1A1 MAPT 3563/4885KMT2A 468/4885ALDH1A1 75/4885
US-20200301230-A1 ELECTROCHROMIC DEVICE COMPRISING ELECTROCHROMIC COMPOUND AND MANUFACTURING METHOD THEREFOR EZH2, ETV6, HSD17B11 MAPT 4349/4885KMT2A 1227/4885ALDH1A1 427/4885

“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.

Send feedback