SCHEMBL24997697

SCHEMBL24997697

CC(C)c1ccc2c(c1)NC(CC(C)c1ccc3cc[nH]c3c1)C2

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.34
▸ AHR P35869 3/20 0.34
▸ TSHR P16473 1/20 0.32
▸ PDE2A O00408 1/20 0.32
▸ CMA1 P23946 1/20 0.31
▸ TYR P14679 1/20 0.31
▸ EIF4A3 P38919 1/20 0.31
▸ CYP19A1 P11511 2/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ ESR1 P03372 2/20 0.30
▸ HTR6 P50406 1/20 0.30
▸ MAOA P21397 1/20 0.30
▸ OPRM1 P35372 1/20 0.30
▸ OPRD1 P41143 1/20 0.30
▸ OPRK1 P41145 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
SCHEMBL83970 0.76 AHR (0.50) MEN1POLBMAPK1KMT2AKDM4E
SCHEMBL15445210 0.73 PNMT (0.44) MEN1MAPK1KMT2AKDM4EALDH1A1
SCHEMBL20883896 0.70 HPGD (0.33) MEN1KMT2ATSHRCREBBP
SCHEMBL3793164 0.70 MEN1 (0.44) MEN1POLBMAPK1KMT2AKDM4E
SCHEMBL19308895 0.69 EIF4A3 (0.43) MEN1POLBMAPK1KMT2AKDM4E
SCHEMBL25085608 0.68 — —
SCHEMBL19954972 0.67 KDM4E (0.36) MEN1POLBMAPK1KMT2AKDM4E
SCHEMBL10299188 0.65 BRD4 (0.41) MAPK1KDM4EALDH1A1TSHRKIF11
SCHEMBL24478699 0.65 MAPT (0.39) MEN1MAPK1KMT2AKDM4EALDH1A1
SCHEMBL21065478 0.65 PNMT (0.39) —

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-20230038589-A1 Methods and compositions for targeting Tregs using CCR8 inhibitors Nanjing Immunophage Biotech Co., Ltd. (CN) 2023-02-09 — — 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-20230038589-A1 Methods and compositions for targeting Tregs using CCR8 inhibitors CCR8, CCR1, CCR3 MEN1 3702/4885POLB 4200/4885MAPK1 1421/4885

“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.

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