SCHEMBL24939007

SCHEMBL24939007

CCNCc1ccccc1C1(C)CC1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
TSHR P16473 2/20 0.38
CYP2D6 P10635 1/20 0.38
HIF1A Q16665 1/20 0.38
HDAC4 P56524 1/20 0.37
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
CA12 O43570 5/20 0.36
CA2 P00918 5/20 0.36
KMT2A Q03164 2/20 0.35
LMNA P02545 1/20 0.35
OPRM1 P35372 3/20 0.35
OPRK1 P41145 2/20 0.35
CA9 Q16790 4/20 0.34
KDM4E B2RXH2 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MPO P05164 1/20 0.33

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
SCHEMBL16869941 0.81 OPRM1 (0.44) GAAHDAC4SLC6A2SLC6A4SLC6A3
SCHEMBL16767685 0.76 OPRM1 (0.43) BACE1KMT2AOPRM1OPRL1BCHE
SCHEMBL16867365 0.73 OPRL1 (0.44) OPRM1OPRK1OPRD1OPRL1
Hydrochloric Acid SCHEMBL28746625 0.72 MEN1 (0.50) GAATSHRCYP2D6HIF1AKMT2A
SCHEMBL11806132 0.71 HDAC4 (0.41) TSHRHDAC4SLC6A2SLC6A4SLC6A3
SCHEMBL6552316 0.71 HTR2A (0.39) GAAKMT2ALMNAOPRM1OPRK1
SCHEMBL16593764 0.70 HDAC4 (0.54) TSHRCYP2D6HDAC4SLC6A2SLC6A4
SCHEMBL14376716 0.70 GAA (0.49) GAATSHRCYP2D6HIF1ASLC6A2
SCHEMBL7930135 0.69 TSHR (0.78) TSHRCYP2D6HIF1ASLC6A4CA12
SCHEMBL19373091 0.69 GAA (0.47) GAATSHRCYP2D6HIF1ASLC6A2

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-11560422-B2 Sulfonamide-containing linkage systems for drug conjugates ZYMEWORKS INC. 2023-01-24 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-11560422-B2 Sulfonamide-containing linkage systems for drug conjugates MPST, TPST2, SULT1A1 GAA 998/4885TSHR 2211/4885CYP2D6 639/4885

“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.