SCHEMBL19862626

SCHEMBL19862626

Cc1ccc(C2CC(=O)NC23CCCCC3)cc1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.42
SLC6A9 P48067 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
GAA P10253 1/20 0.39
OPRM1 P35372 1/20 0.37
AKR1B1 P15121 1/20 0.36
KMT2A Q03164 3/20 0.36
SIRT1 Q96EB6 1/20 0.35
THRB P10828 2/20 0.35
RAB9A P51151 2/20 0.33
PDE7A Q13946 1/20 0.33
NPC1 O15118 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
SCHEMBL18590513 1.00 POLB (0.42) POLBSLC6A9SMN1; SMN2GAAOPRM1
SCHEMBL19862623 0.98 SMN1; SMN2 (0.40) POLBSLC6A9SMN1; SMN2GAAOPRM1
SCHEMBL18590511 0.98 SMN1; SMN2 (0.40) POLBSLC6A9SMN1; SMN2GAAOPRM1
SCHEMBL19559433 0.84 DDB1 (0.43) SMN1; SMN2GAAAKR1B1KMT2ARAB9A
SCHEMBL20041908 0.82 DDB1 (0.44) SMN1; SMN2GAAKMT2APDE7ANPC1
SCHEMBL19559384 0.82 DDB1 (0.44) SMN1; SMN2GAAKMT2APDE7ANPC1
SCHEMBL19862624 0.77 SMN1; SMN2 (0.43) SMN1; SMN2GAAKMT2ASIRT1THRB
SCHEMBL19862621 0.71 POLB (0.41) POLBSLC6A9SMN1; SMN2AKR1B1KMT2A
SCHEMBL18590479 0.71 POLB (0.41) POLBSLC6A9SMN1; SMN2AKR1B1KMT2A
SCHEMBL19095210 0.71 SLC6A9 (0.37) POLBSLC6A9OPRM1AKR1B1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10029983-B2 Urea derivative or pharmacologically acceptable salt thereof KYORIN PHARMACEUTICAL CO., LTD. (JP) 2018-07-24 US disclosed
US-20180044290-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF KYORIN SEIYAKU KK (JP) 2018-02-15 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 (2 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-10029983-B2 Urea derivative or pharmacologically acceptable salt thereof FPR1, FPR2, FPR3 POLB 4654/4885SLC6A9 680/4885SMN1; SMN2 3809/4885
US-20180044290-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF FPR1, FPR2, FPR3 POLB 4654/4885SLC6A9 680/4885SMN1; SMN2 3809/4885

“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.