SCHEMBL24017172

SCHEMBL24017172

CCc1cc(C#N)cc(CC)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 2/20 0.43
ALDH1A1 P00352 4/20 0.39
MAPT P10636 2/20 0.39
HTT P42858 1/20 0.39
TTR P02766 2/20 0.38
ALB P02768 2/20 0.38
GPR35 Q9HC97 1/20 0.37
POLB P06746 1/20 0.36
VCAM1 P19320 2/20 0.35
EGLN2 Q96KS0 1/20 0.35
PGR P06401 1/20 0.34
ABCC9 O60706 1/20 0.34
ABCC8 Q09428 1/20 0.34
KCNJ11 Q14654 1/20 0.34
KCNJ8 Q15842 1/20 0.34
KCNH2 Q12809 2/20 0.33
KDM4E B2RXH2 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
LMNA P02545 1/20 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
SCHEMBL2154258 0.83 CYP2A6 (0.44) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL24017194 0.82 MEN1 (0.37) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL2154515 0.81 CYP2A6 (0.43) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL2154472 0.79 CYP2A6 (0.41) CYP2A6ALDH1A1MAPTTTRALB
SCHEMBL7928482 0.79 HTT (0.46) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL2154144 0.79 CYP2A6 (0.41) CYP2A6ALDH1A1MAPTTTRALB
SCHEMBL7928478 0.79 CYP2A6 (0.41) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL1175919 0.77 ALDH1A1 (0.57) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL1175359 0.77 TTR (0.45) CYP2A6ALDH1A1MAPTHTTTTR
SCHEMBL1174938 0.77 MEN1 (0.36) CYP2A6ALDH1A1MAPTHTTTTR

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-11858952-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-01-02 US disclosed
US-11858952-B2 Compound and color conversion film comprising same LG CHEM, LTD. (KR) 2024-01-02 US disclosed
US-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME LG CHEM, LTD. (KR) 2021-11-11 US disclosed
CN-106083927-A Phosphinyl amidine compound, metal complex, antigravity system and their oligomeric or purposes of olefin polymerization 切弗朗菲利浦化学公司 2016-11-09 CN 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-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME BLVRB, CDYL, CRY1 CYP2A6 424/4885ALDH1A1 689/4885MAPT 360/4885
US-11858952-B2 Compound and color conversion film comprising same BLVRB, CDYL, CRY1 CYP2A6 424/4885ALDH1A1 689/4885MAPT 360/4885

“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.