SCHEMBL30998688

SCHEMBL30998688

CC(C)(OC(=O)N1CC2NC(C1)C1CC21)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RORC P51449 1/20 0.40
▸ GPR119 Q8TDV5 1/20 0.37
▸ NAMPT P43490 1/20 0.36
▸ USP30 Q70CQ3 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ ALOX15 P16050 1/20 0.36
▸ PAX8 Q06710 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ JAK2 O60674 1/20 0.35
▸ JAK1 P23458 1/20 0.35
▸ CHRM2 P08172 3/20 0.34
▸ CHRM4 P08173 3/20 0.34
▸ CHRM5 P08912 3/20 0.34
▸ CHRM1 P11229 3/20 0.34
▸ CHRM3 P20309 3/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ SSTR4 P31391 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
SCHEMBL30998629 0.81 RORC (0.42) RORCGPR119NAMPTUSP30ALDH1A1
SCHEMBL23906938 0.78 NR1H2 (0.51) RORCNAMPTALDH1A1KDM4ECHRM2
SCHEMBL10186558 0.73 SMN1; SMN2 (0.51) GPR119ALDH1A1ALOX15
SCHEMBL29828015 0.70 RORC (0.47) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL24894442 0.70 RORC (0.47) RORCGPR119NAMPTUSP30KDM4E
SCHEMBL12551255 0.70 FAAH (0.43) GPR119ALDH1A1ALOX15KDM4EMAPK1
SCHEMBL15313304 0.68 NR1H2 (0.53) RORCGPR119NAMPTALDH1A1KDM4E
SCHEMBL22773288 0.67 RORC (0.55) RORCGPR119NAMPTUSP30ALDH1A1
SCHEMBL25191894 0.67 HPGD (0.45) GPR119USP30ALDH1A1KDM4EMAPK1
SCHEMBL25330133 0.67 RORC (0.49) RORCGPR119NAMPTUSP30KDM4E

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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT TAIHO PHARMACEUTICAL CO., LTD. (JP) 2024-07-18 — — 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-20240239788-A1 SMALL MOLECULE INHIBITORS OF KRAS G12D MUTANT KRAS, NRAS, HRAS RORC 2746/4885GPR119 3004/4885NAMPT 3319/4885

“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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