SCHEMBL7019955

SCHEMBL7019955

O=Cc1cnc(NC(=O)O)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK2A2 P19784 1/20 0.47
CSNK2B P67870 1/20 0.47
CSNK2A1 P68400 1/20 0.47
CSNK2A3 Q8NEV1 1/20 0.47
GSTO1 P78417 1/20 0.39
ALDH1A1 P00352 2/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
NPC1 O15118 4/20 0.38
RAB9A P51151 4/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDR P35968 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.37
CCNE1 P24864 2/20 0.37
CDK2 P24941 2/20 0.37
CDK5 Q00535 2/20 0.37
TP53 P04637 1/20 0.37
KCNJ1 P48048 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
SCHEMBL10227543 0.84 CSNK2A2 (0.46) CSNK2A2CSNK2BCSNK2A1CSNK2A3GSTO1
SCHEMBL4100380 0.84 CSNK2A2 (0.46) CSNK2A2CSNK2BCSNK2A1CSNK2A3MEN1
SCHEMBL10226204 0.84 CSNK2A2 (0.46) CSNK2A2CSNK2BCSNK2A1CSNK2A3GSTO1
SCHEMBL10176144 0.81 SMN1; SMN2 (0.51) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1
SCHEMBL31128796 0.80 CSNK2A2 (0.43) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1
SCHEMBL10176155 0.80 SMN1; SMN2 (0.55) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1
SCHEMBL20284274 0.80 SMN1; SMN2 (0.46) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1
SCHEMBL10176139 0.79 ALDH1A1 (0.48) ALDH1A1SMN1; SMN2NPC1RAB9AMEN1
SCHEMBL12469715 0.77 PTGS2 (0.40) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1
SCHEMBL10227546 0.76 CSNK2A2 (0.41) CSNK2A2CSNK2BCSNK2A1CSNK2A3ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF RELAY THERAPEUTICS, INC. 2024-06-13 US disclosed
EP-4291176-A1 CDK INHIBITORS AND METHODS OF USE THEREOF Relay Therapeutics, Inc. (US) 2023-12-20 EP disclosed
US-20210198288-A1 PENICILLIN-BINDING PROTEIN INHIBITORS VenatoRx Pharmaceuticals, Inc. 2021-07-01 US disclosed
EP-3802551-A1 PENICILLIN-BINDING PROTEIN INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2021-04-14 EP disclosed
EP-3630783-A1 PENICILLIN-BINDING PROTEIN INHIBITORS Venatorx Pharmaceuticals, Inc. (US) 2020-04-08 EP disclosed
US-20200102331-A1 PENICILLIN-BINDING PROTEIN INHIBITORS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-04-02 US disclosed
WO-2018218154-A1 PENICILLIN-BINDING PROTEIN INHIBITORS VenatoRx Pharmaceuticals, Inc. (US) 2018-11-29 WO disclosed
US-9169295-B2 Macrocycles and macrocycle stabilized peptides BRISTOL-MYERS SQUIBB COMPANY (US) 2015-10-27 US disclosed
EP-2627662-B1 METHODS FOR PREPARING MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL MYERS SQUIBB CO (US) 2015-09-16 EP disclosed
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES BRISTOL-MYERS SQUIBB COMPANY (US) 2013-10-24 US disclosed
US-20030232860-A1 Medicine comprising dicyanopyridine derivative ASTELLAS PHARMA INC. (JP) 2003-12-18 US disclosed
EP-1302463-A1 MEDICINE COMPRISING DICYANOPYRIDINE DERIVATIVE YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 2003-04-16 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 (5 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-20200102331-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL CSNK2A2 3375/4885CSNK2B 2862/4885CSNK2A1 3509/4885
US-20210198288-A1 PENICILLIN-BINDING PROTEIN INHIBITORS PEPD, BPGM, EBPL CSNK2A2 3375/4885CSNK2B 2862/4885CSNK2A1 3509/4885
US-20130281657-A1 MACROCYCLES AND MACROCYCLE STABILIZED PEPTIDES PTMS, VIP, MTPN CSNK2A2 2005/4885CSNK2B 1944/4885CSNK2A1 1778/4885
US-20030232860-A1 Medicine comprising dicyanopyridine derivative KCNN3, KCNN2, KCNN1 CSNK2A2 2419/4885CSNK2B 2796/4885CSNK2A1 2717/4885
US-20240190855-A1 CDK INHIBITORS AND METHODS OF USE THEREOF CDK3, CDK8, CDK6 CSNK2A2 73/4885CSNK2B 70/4885CSNK2A1 75/4885

“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.