SCHEMBL480202

SCHEMBL480202

NCC(=O)NC(=O)N1CCCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.42
HTT P42858 3/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
RAB9A P51151 2/20 0.40
TP53 P04637 1/20 0.40
HPGD P15428 1/20 0.40
KMT2A Q03164 4/20 0.37
MEN1 O00255 1/20 0.37
CYP1A2 P05177 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C19 P33261 1/20 0.37
ATM Q13315 1/20 0.37
ALOX15 P16050 1/20 0.37
ALDH1A1 P00352 2/20 0.36
POLB P06746 2/20 0.35
HSD11B1 P28845 1/20 0.35
MAPT P10636 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35
NPC1 O15118 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
SCHEMBL7700237 0.98 GAA (0.44) GAAHTTSMN1; SMN2RAB9ATP53
SCHEMBL6324391 0.80 GAA (0.43) GAAHTTSMN1; SMN2RAB9ATP53
SCHEMBL5406500 0.78 GAA (0.52) GAAHTTSMN1; SMN2RAB9AKMT2A
SCHEMBL7698684 0.77 KMT2A (0.40) GAAHTTSMN1; SMN2RAB9ATP53
SCHEMBL4630170 0.74 KMT2A (0.47) GAAHTTSMN1; SMN2RAB9ATP53
SCHEMBL1882976 0.73 GAA (0.48) GAAHTTSMN1; SMN2RAB9AHPGD
SCHEMBL9184806 0.73 GAA (0.48) GAAHTTSMN1; SMN2RAB9AHPGD
SCHEMBL47336 0.73 KMT2A (0.48) HTTKMT2AATMALDH1A1POLB
SCHEMBL10475080 0.72 ALDH1A1 (0.45) GAAHTTSMN1; SMN2RAB9ATP53
SCHEMBL23152448 0.72 GAA (0.52) GAAHTTSMN1; SMN2RAB9AKMT2A

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8143427-B2 Method for producing aminoacetylpyrrolidinecarbonitrile derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-03-27 US claimed
EP-2123636-B1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN SEIYAKU KK (JP) 2012-03-21 EP claimed
US-20120029032-A1 MATRIX-TYPE SUSTAINED RELEASE PREPARATION CONTAINING BASIC ADDITIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-02-02 US claimed
EP-2412370-A1 MATRIX-TYPE SUSTAINED RELEASE PREPARATION CONTAINING BASIC ADDITIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2012-02-01 EP claimed
US-20100099892-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN PHARMACEUTICAL CO. LTD 2010-04-22 US claimed
EP-2123636-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2009-11-25 EP claimed
US-8143427-B2 Method for producing aminoacetylpyrrolidinecarbonitrile derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-03-27 US disclosed
US-8143427-B2 Method for producing aminoacetylpyrrolidinecarbonitrile derivative KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-03-27 US disclosed
EP-2123636-B1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN SEIYAKU KK (JP) 2012-03-21 EP disclosed
EP-2123636-B1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN SEIYAKU KK (JP) 2012-03-21 EP disclosed
US-20120029032-A1 MATRIX-TYPE SUSTAINED RELEASE PREPARATION CONTAINING BASIC ADDITIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2012-02-02 US disclosed
EP-2412370-A1 MATRIX-TYPE SUSTAINED RELEASE PREPARATION CONTAINING BASIC ADDITIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2012-02-01 EP disclosed
US-7915427-B2 Process for producing aminoacetyl pyrrolidine carbonitrile derivative and intermediate for production thereof KYORIN PHARMACEUTICALS CO., LTD. (JP) 2011-03-29 US disclosed
JP-2010070454-A METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE AND PRODUCTION INTERMEDIATE OF THE SAME KYORIN PHARMACEUT CO LTD 2010-04-02 JP disclosed
EP-2123636-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2009-11-25 EP disclosed
EP-2123636-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE Kyorin Pharmaceutical Co., Ltd. (JP) 2009-11-25 EP disclosed
JP-2009114127-A METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN PHARMACEUT CO LTD 2009-05-28 JP disclosed
US-20090048454-A1 Process for Producing Aminoacetyl Pyrrolidine Carbonitrile Derivative and Intermediate for Production Thereof KYORIN PHARMACEUTICALS CO., LTD. (JP) 2009-02-19 US disclosed
EP-1995237-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE AND PRODUCTION INTERMEDIATE THEREOF Kyorin Pharmaceutical Co., Ltd. (JP) 2008-11-26 EP disclosed
WO-2008114857-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE KYORIN PHARMACEUTICAL CO., LTD. (JP) 2008-09-25 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 (3 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-20100099892-A1 METHOD FOR PRODUCING AMINOACETYLPYRROLIDINECARBONITRILE DERIVATIVE DPP4, DPP7, DPP8 GAA 1799/4885HTT 3515/4885SMN1; SMN2 4352/4885
US-20090048454-A1 Process for Producing Aminoacetyl Pyrrolidine Carbonitrile Derivative and Intermediate for Production Thereof CBR3, CPS1, CBR1 GAA 3647/4885HTT 1675/4885SMN1; SMN2 3794/4885
US-20120029032-A1 MATRIX-TYPE SUSTAINED RELEASE PREPARATION CONTAINING BASIC ADDITIVE MMP7, COL2A1, MMP17 GAA 79/4885HTT 3209/4885SMN1; SMN2 832/4885

“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.