SCHEMBL19862623

SCHEMBL19862623

Cc1ccc(C2CC(=O)NC23CCCC3)cc1

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.40
GAA P10253 1/20 0.40
POLB P06746 1/20 0.40
SLC6A9 P48067 4/20 0.38
SIRT1 Q96EB6 1/20 0.36
THRB P10828 2/20 0.35
OPRM1 P35372 1/20 0.35
AKR1B1 P15121 1/20 0.35
KMT2A Q03164 3/20 0.34
MAPT P10636 1/20 0.34
ATM Q13315 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
ALDH1A1 P00352 3/20 0.34
MEN1 O00255 1/20 0.34
CYP3A4 P08684 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 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
SCHEMBL18590511 1.00 SMN1; SMN2 (0.40) SMN1; SMN2GAAPOLBSLC6A9SIRT1
SCHEMBL18590513 0.98 POLB (0.42) SMN1; SMN2GAAPOLBSLC6A9SIRT1
SCHEMBL19862626 0.98 POLB (0.42) SMN1; SMN2GAAPOLBSLC6A9SIRT1
SCHEMBL20041908 0.83 DDB1 (0.44) SMN1; SMN2GAAKMT2AALDH1A1MEN1
SCHEMBL19559384 0.83 DDB1 (0.44) SMN1; SMN2GAAKMT2AALDH1A1MEN1
SCHEMBL19559433 0.82 DDB1 (0.43) SMN1; SMN2GAAAKR1B1KMT2AALDH1A1
SCHEMBL19862624 0.78 SMN1; SMN2 (0.43) SMN1; SMN2GAASIRT1THRBKMT2A
SCHEMBL19095210 0.72 SLC6A9 (0.37) POLBSLC6A9OPRM1AKR1B1KMT2A
SCHEMBL18590478 0.70 NPSR1 (0.40) SMN1; SMN2POLBSLC6A9THRBAKR1B1
SCHEMBL19862627 0.70 NPSR1 (0.40) SMN1; SMN2POLBSLC6A9THRBAKR1B1

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 SMN1; SMN2 3809/4885GAA 3976/4885POLB 4654/4885
US-20180044290-A1 UREA DERIVATIVE OR PHARMACOLOGICALLY ACCEPTABLE SALT THEREOF FPR1, FPR2, FPR3 SMN1; SMN2 3809/4885GAA 3976/4885POLB 4654/4885

“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.