SCHEMBL24703151

SCHEMBL24703151

CN(C)c1ccccc1CCI

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.41
HPGD P15428 1/20 0.41
ALOX15 P16050 1/20 0.41
ALOX12 P18054 1/20 0.41
CASP1 P29466 1/20 0.41
HSD17B10 Q99714 1/20 0.41
AR P10275 1/20 0.38
MAPT P10636 3/20 0.38
GAA P10253 2/20 0.38
TP53 P04637 1/20 0.38
TSHR P16473 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
KDM4E B2RXH2 1/20 0.37
CHEK1 O14757 1/20 0.36
NEK2 P51955 1/20 0.36
LIMK1 P53667 1/20 0.36
DYRK1A Q13627 1/20 0.36
CLK4 Q9HAZ1 1/20 0.36
GLI1 P08151 1/20 0.36
CYP3A4 P08684 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
SCHEMBL249635 0.83 MAPT (0.42) ALDH1A1ARMAPTGAATP53
SCHEMBL18513190 0.80 ALDH1A1 (0.35) ALDH1A1HPGDALOX15ALOX12CASP1
SCHEMBL5224493 0.80 AR (0.39) ALDH1A1ARMAPTGAATP53
SCHEMBL6907203 0.80 AR (0.39) ALDH1A1ARMAPTGAATP53
SCHEMBL6561651 0.79 AR (0.36) ALDH1A1ARMAPTGAATP53
SCHEMBL24505552 0.79 HTR1A (0.39) ALDH1A1HPGDALOX15ALOX12CASP1
SCHEMBL3842121 0.78 TAAR1 (0.54) ALDH1A1ARMAPTGAATP53
SCHEMBL249636 0.78 PTPN1 (0.47) ALDH1A1ARMAPTGAATP53
SCHEMBL5542900 0.78 AR (0.38) ALDH1A1ARMAPTGAATP53
SCHEMBL5609758 0.78 AR (0.38) ALDH1A1ARMAPTGAATP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220399517-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-12-15 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 (1 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-20220399517-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, OSGEP ALDH1A1 1043/4885HPGD 1146/4885ALOX15 1940/4885

“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.