SCHEMBL24974753

SCHEMBL24974753

CC(C)(C)/C=C/c1ccccc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALOX12 P18054 1/20 0.39
CA2 P00918 1/20 0.38
NFKB1 P19838 1/20 0.36
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
PDE3B Q13370 1/20 0.33
PDE3A Q14432 1/20 0.33
KIF11 P52732 1/20 0.32
MAOB P27338 6/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31
HSD17B10 Q99714 1/20 0.31
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL8576453 0.86 ALDH1A1 (0.48) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL10382469 0.80 ALDH1A1 (0.43) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL31348027 0.80 ALDH1A1 (0.43) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL8857069 0.78 ALDH1A1 (0.41) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL29801228 0.77 ALDH1A1 (0.50) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL27805 0.77 ALDH1A1 (0.50) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL241267 0.77 NFE2L2 (0.50) ALDH1A1TSHRTDP1MAOBTNFRSF1A
SCHEMBL241265 0.77 NFE2L2 (0.50) ALDH1A1TSHRTDP1MAOBTNFRSF1A
SCHEMBL596277 0.77 ALDH1A1 (0.48) ALDH1A1TSHRTDP1ALOX12CA2
SCHEMBL5435012 0.77 ALDH1A1 (0.48) ALDH1A1TSHRTDP1ALOX12CA2

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-11572370-B2 CD16A binding agents and uses thereof BIOHAVEN THERAPEUTICS LTD. (US) 2023-02-07 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-11572370-B2 CD16A binding agents and uses thereof FCGR1A, FCGR2A, FCGR3B ALDH1A1 1203/4885TSHR 1233/4885TDP1 2251/4885

“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.