SCHEMBL24490366

SCHEMBL24490366

CNc1ccc(C(C)C(C)C)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.42
APP P05067 4/20 0.38
ALDH1A1 P00352 4/20 0.37
HSD17B10 Q99714 3/20 0.37
RECQL P46063 2/20 0.37
TP53 P04637 2/20 0.37
CYP3A4 P08684 2/20 0.37
THRB P10828 2/20 0.37
ALOX15 P16050 2/20 0.37
CASP1 P29466 2/20 0.37
HIF1A Q16665 2/20 0.37
CA12 O43570 1/20 0.37
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
HPGD P15428 1/20 0.37
KIF11 P52732 1/20 0.35
ADRA2A P08913 1/20 0.35
ADRA2B P18089 1/20 0.35
ADRA2C P18825 1/20 0.35
MAPT P10636 1/20 0.34

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
SCHEMBL9320342 0.79 ESR1 (0.48) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL170685 0.79 NFKB1 (0.47) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL13654315 0.78 ALDH1A1 (0.50) TSHRALDH1A1HSD17B10TP53CYP3A4
SCHEMBL19901337 0.78 TDP1 (0.52) TSHRALDH1A1HSD17B10RECQLTP53
Hydrochloric Acid SCHEMBL2865053 0.77 NFKB1 (0.45) TSHRAPPALDH1A1CA12CA1
SCHEMBL14217145 0.76 TSHR (0.39) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL2495683 0.76 TSHR (0.48) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL24398903 0.75 TSHR (0.42) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL20969629 0.75 ADRB2 (0.52) TSHRAPPALDH1A1HSD17B10RECQL
SCHEMBL24017762 0.75 NOS3 (0.42) TSHRAPPALDH1A1HSD17B10RECQL

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-20220175944-A1 ANTI-CD117 ANTIBODY-DRUG CONJUGATES AND USES THEREOF Magenta Therapeutics, Inc. 2022-06-09 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-20220175944-A1 ANTI-CD117 ANTIBODY-DRUG CONJUGATES AND USES THEREOF ITGB7, KIT, CD2 TSHR 1311/4885APP 4667/4885ALDH1A1 93/4885

“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.