SCHEMBL24017151

SCHEMBL24017151

CC(C)c1cc(-c2ccc(C#N)cc2)cc(C(C)C)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 3/20 0.47
MMP3 P08254 4/20 0.47
GRIA1 P42261 1/20 0.43
GRIA2 P42262 1/20 0.43
GRIA3 P42263 1/20 0.43
GRIA4 P48058 1/20 0.43
CYP2A6 P11509 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SCN10A Q9Y5Y9 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA9 Q16790 1/20 0.40
XDH P47989 1/20 0.40
TSHR P16473 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CYP11B2 P19099 1/20 0.39
MMP2 P08253 4/20 0.39
HRH3 Q9Y5N1 2/20 0.38
MMP1 P03956 2/20 0.38

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
SCHEMBL12263202 0.85 MMP3 (0.52) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL24726522 0.83 RXRA (0.54) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL25712289 0.82 ERBB2 (0.46) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL3818110 0.79 KIF11 (0.39) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL23625544 0.79 CYP11B2 (0.43) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL6667915 0.78 TTR (0.41) CYP2A6ALDH1A1TSHRERBB2
SCHEMBL87339 0.78 CYP2A6 (0.52) KIF11GRIA1GRIA2GRIA3GRIA4
SCHEMBL24617563 0.78 HRH3 (0.50) KIF11MMP3GRIA1GRIA2GRIA3
SCHEMBL3611983 0.78 MMP3 (0.64) KIF11MMP3CYP2A6ALDH1A1CA12
SCHEMBL16789941 0.78 MMP3 (0.64) KIF11MMP3CYP2A6ALDH1A1CA12

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 2 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-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME LG CHEM, LTD. (KR) 2021-11-11 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-20210347790-A1 COMPOUND AND COLOR CONVERSION FILM COMPRISING SAME BLVRB, CDYL, CRY1 KIF11 3482/4885MMP3 3849/4885GRIA1 2529/4885
US-11858952-B2 Compound and color conversion film comprising same BLVRB, CDYL, CRY1 KIF11 3482/4885MMP3 3849/4885GRIA1 2529/4885

“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.