SCHEMBL24036726

SCHEMBL24036726

COC(=O)C[C@H](NC(=O)CN)c1cccc(C2CC2)c1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 6/20 0.39
PRKG1 Q13976 3/20 0.39
TACR3 P29371 1/20 0.37
FFAR1 O14842 2/20 0.37
KLRK1 P26718 1/20 0.36
MICA Q29983 1/20 0.36
RAET1L Q5VY80 1/20 0.36
ROCK1 Q13464 2/20 0.36
PRCP P42785 1/20 0.35
RAB9A P51151 1/20 0.35
WDR5 P61964 1/20 0.35
CNR2 P34972 1/20 0.35
POLB P06746 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL24036728 0.83 ROCK2 (0.44) ROCK2FFAR1ROCK1POLBKMT2A
SCHEMBL27406042 0.82 CACNA1B (0.43) ROCK2PRKG1TACR3RAB9A
SCHEMBL29861275 0.82 CACNA1B (0.43) ROCK2PRKG1TACR3RAB9A
SCHEMBL25624750 0.81 CACNA1B (0.38) ROCK2PRKG1RAB9A
SCHEMBL24036748 0.81 CACNA1B (0.38) ROCK2PRKG1RAB9A
SCHEMBL24036727 0.81 KCNA5 (0.47) TACR3WDR5POLBKMT2A
SCHEMBL24036731 0.81 WDR5 (0.50) TACR3WDR5CNR2KMT2A
SCHEMBL24036950 0.81 TACR3 (0.39) ROCK2PRKG1TACR3ROCK1RAB9A
SCHEMBL24037112 0.80 ROCK2 (0.38) ROCK2PRKG1FFAR1KMT2A
Hydrochloric Acid SCHEMBL29861388 0.79 ROCK2 (0.38) ROCK2PRKG1FFAR1KMT2A

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE UBE CORPORATION (JP) 2023-06-22 US disclosed
WO-2023085396-A1 PHARMACEUTICAL COMPOSITION FOR PROVIDING TREATMENT FOR OR PREVENTING ALPORT SYNDROME UBE株式会社 2023-05-19 WO disclosed
WO-2021230325-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE 宇部興産株式会社 2021-11-18 WO 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-20230192661-A1 1, 4, 5, 6-TETRAHYDROPYRIMIDINE-2-AMINE DERIVATIVE DHFR, DPYD, CYP2D6 ROCK2 3623/4885PRKG1 4133/4885TACR3 2946/4885

“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.