SCHEMBL21160014

SCHEMBL21160014

CC1CCC(NC(=S)NN(c2ccccc2)c2ccccc2)CC1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 4/20 0.63
LMNA P02545 1/20 0.63
MEN1 O00255 2/20 0.50
KMT2A Q03164 2/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
ALDH1A1 P00352 3/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ALOX12 P18054 3/20 0.43
MAPT P10636 2/20 0.43
CRHBP P24387 1/20 0.43
HTT P42858 1/20 0.43
CRHR2 Q13324 1/20 0.43
HPGD P15428 1/20 0.41
GPR55 Q9Y2T6 1/20 0.41
ALPL P05186 1/20 0.38
ALPI P09923 1/20 0.38
ALPG P10696 1/20 0.38
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
PKM P14618 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
SCHEMBL21159809 0.84 GAA (0.73) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL22382010 0.84 GAA (0.73) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL21159807 0.83 LMNA (0.43) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL19924470 0.78 LMNA (1.00) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL21160366 0.76 GAA (0.69) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL21159808 0.76 GAA (0.69) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL21160004 0.67 RAB9A (0.49) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL2152542 0.65 KMT2A (0.66) GAALMNAMEN1KMT2ASMN1; SMN2
SCHEMBL11813198 0.61 AGTR2 (0.44) MEN1KMT2AALDH1A1PKM
SCHEMBL21159803 0.61 GAA (0.49) GAALMNAMEN1KMT2ASMN1; SMN2

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-10759749-B2 Therapeutic agent for diabetes JCR PHARMACEUTICALS CO., LTD. (JP) 2020-09-01 US disclosed
US-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES JCR PHARMACEUTICALS CO., LTD. (JP) 2019-07-04 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-20190202781-A1 NOVEL THERAPEUTIC AGENT FOR DIABETES GPR119, IAPP, DPP4 GAA 101/4885LMNA 4657/4885MEN1 4253/4885
US-10759749-B2 Therapeutic agent for diabetes GPR119, IAPP, DPP4 GAA 58/4885LMNA 4517/4885MEN1 3662/4885

“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.