SCHEMBL4954432

SCHEMBL4954432

Cc1ccc(NC(=O)C(=S)NN(C(=O)O)C2CCC[C@H](C(=O)N(C)C)C2)nc1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.43
MAPT P10636 2/20 0.43
POLB P06746 2/20 0.37
LMNA P02545 1/20 0.36
MEN1 O00255 3/20 0.34
KMT2A Q03164 3/20 0.34
NPC1 O15118 3/20 0.34
PKM P14618 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRL1 P41146 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 1/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
RXFP1 Q9HBX9 1/20 0.33
CYP2C19 P33261 1/20 0.33
HTT P42858 1/20 0.33
GLA P06280 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL1504138 0.90 L3MBTL1 (0.42) RAB9AMAPTNPC1KDM4EALDH1A1
SCHEMBL1504064 0.90 GRM5 (0.38) OPRM1OPRL1
SCHEMBL4955316 0.81 KCNQ3 (0.36)
SCHEMBL1503995 0.81 L3MBTL1 (0.44) RAB9ALMNANPC1L3MBTL1
SCHEMBL4260523 0.78 L3MBTL1 (0.41) RAB9AMAPTNPC1KDM4EALDH1A1
SCHEMBL4954407 0.77 RAB9A (0.44) RAB9AMAPTPOLBLMNAMEN1
SCHEMBL6891046 0.77 PRMT5 (0.31) MAPTMEN1KMT2AKEAP1NFE2L2
SCHEMBL4955372 0.76 L3MBTL1 (0.44) RAB9AMAPTNPC1ALDH1A1L3MBTL1
SCHEMBL4955407 0.76 GLS (0.33)
SCHEMBL4261370 0.71 REN (0.31) LMNAKMT2A

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-7342014-B2 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2008-03-11 US disclosed
US-20050020645-A1 Diamine derivatives DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2005-01-27 US disclosed
EP-1415992-A1 DIAMINE DERIVATIVES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-05-06 EP 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-20050020645-A1 Diamine derivatives C9, C1S, C1R RAB9A 3294/4885MAPT 4271/4885POLB 868/4885

“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.