SCHEMBL6440649

SCHEMBL6440649

CC(=O)[C@H](C)NC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CTSK P43235 5/20 0.60
CTSS P25774 4/20 0.60
CTSL P07711 3/20 0.60
CTSB P07858 2/20 0.60
ATM Q13315 1/20 0.59
ALDH1A1 P00352 2/20 0.58
ALOX15 P16050 1/20 0.58
MEN1 O00255 2/20 0.57
LMNA P02545 2/20 0.57
KMT2A Q03164 2/20 0.57
CTRB1 P17538 2/20 0.56
ELANE P08246 1/20 0.56

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
SCHEMBL13503291 1.00 CTSK (0.60) CTSKCTSSCTSLCTSBATM
SCHEMBL15080869 0.89 CTSK (0.61) CTSKCTSSCTSLCTSBATM
SCHEMBL30946598 0.89 CTSK (0.61) CTSKCTSSCTSLCTSBATM
SCHEMBL856196 0.89 CTSK (0.61) CTSKCTSSCTSLCTSBATM
SCHEMBL241565 0.89 CTSK (0.61) CTSKCTSSCTSLCTSBATM
SCHEMBL241564 0.89 CTSK (0.61) CTSKCTSSCTSLCTSBATM
SCHEMBL13637586 0.87 CASP3 (0.58) CTSKCTSSCTSLCTSBATM
SCHEMBL5412160 0.87 MAPT (0.61) CTSKCTSSCTSLCTSBATM
Hydrochloric Acid SCHEMBL7400990 0.87 CTSK (0.60) CTSKCTSSCTSLCTSBATM
Hydrochloric Acid SCHEMBL7400995 0.87 CTSK (0.60) CTSKCTSSCTSLCTSBATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10662185-B2 Amino-substituted imidazo[1,2-A] pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2020-05-26 US disclosed
US-20190248783-A9 AMINO-SUBSTITUTED IMIDAZO[1,2-A] PYRIDINECARBOXAMIDES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-08-15 US disclosed
US-20170182014-A1 AMINO-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-06-29 US disclosed
US-9624214-B2 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-04-18 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
US-20150274719-A1 AMINO-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-10-01 US disclosed
US-9126998-B2 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use Bayer Pharma AG (DE) 2015-09-08 US disclosed
US-20140128372-A1 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2014-05-08 US disclosed
US-6924397-B2 Process for the preparation of α-chloroketones from alkyl esters BRISTOL-MYERS SQUIBB COMPANY (US) 2005-08-02 US disclosed
US-20050090670-A1 PROCESS FOR THE PREPARATION OF ALPHA-CHLOROKETONES FROM ALKYL ESTERS BRISTOL-MYERS SQUIBB COMPANY 2005-04-28 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 (7 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-20050090670-A1 PROCESS FOR THE PREPARATION OF ALPHA-CHLOROKETONES FROM ALKYL ESTERS KHK, BCKDK, STS CTSK 39/4885CTSS 430/4885CTSL 418/4885
US-20140128372-A1 Amino-substituted imidazo[1,2-a]pyridinecarboxamides and their use AADAC, TNNI3, PAICS CTSK 3831/4885CTSS 3685/4885CTSL 2319/4885
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 CTSK 4163/4885CTSS 4253/4885CTSL 4166/4885
US-20190248783-A9 AMINO-SUBSTITUTED IMIDAZO[1,2-A] PYRIDINECARBOXAMIDES AND THEIR USE AADAC, TNNI3, PAICS CTSK 3831/4885CTSS 3685/4885CTSL 2319/4885
US-10662185-B2 Amino-substituted imidazo[1,2-A] pyridinecarboxamides and their use AADAC, TNNI3, TNNT2 CTSK 3797/4885CTSS 3625/4885CTSL 2240/4885
US-20150274719-A1 AMINO-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE AADAC, TNNI3, PAICS CTSK 3831/4885CTSS 3685/4885CTSL 2319/4885
US-20170182014-A1 AMINO-SUBSTITUTED IMIDAZO[1,2-A]PYRIDINECARBOXAMIDES AND THEIR USE AADAC, TNNI3, PAICS CTSK 3831/4885CTSS 3685/4885CTSL 2319/4885

“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.