SCHEMBL24017192

SCHEMBL24017192

COc1ccc(I)c(-c2cc(C)c(C)cc2C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SHMT2 P34897 1/20 0.40
ALDH1A1 P00352 4/20 0.38
MEN1 O00255 3/20 0.38
KMT2A Q03164 3/20 0.38
MAPT P10636 3/20 0.38
CYP1A2 P05177 2/20 0.38
RAB9A P51151 2/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
APP P05067 1/20 0.38
SNCA P37840 1/20 0.38
DHFR P00374 1/20 0.38
CA1 P00915 3/20 0.36
CA2 P00918 3/20 0.36
CA7 P43166 3/20 0.36
CA9 Q16790 3/20 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
SCHEMBL7121378 0.86 CA1 (0.48) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL22367114 0.76 C1R (0.45) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL7778479 0.76 ABL1 (0.52) ALDH1A1KMT2ACYP1A2RAB9ACYP2D6
SCHEMBL31229124 0.76 CA12 (0.46) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL3545988 0.76 CA12 (0.46) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL4224633 0.73 BACE1 (0.51) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL24017167 0.73 CYP1A2 (0.37) ALDH1A1MEN1KMT2AMAPTCYP1A2
Fluoride SCHEMBL14361225 0.72 BACE1 (0.50) ALDH1A1MEN1KMT2AMAPTCYP1A2
SCHEMBL28299268 0.72 CYP3A4 (0.55) ALDH1A1CYP1A2CYP3A4CYP2D6CYP2C9
SCHEMBL18016419 0.71 CYP11B1 (0.40) ALDH1A1MEN1KMT2AMAPTCYP1A2

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 SHMT2 4180/4885ALDH1A1 689/4885MEN1 456/4885
US-11858952-B2 Compound and color conversion film comprising same BLVRB, CDYL, CRY1 SHMT2 4180/4885ALDH1A1 689/4885MEN1 456/4885

“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.