SCHEMBL19742662

SCHEMBL19742662

CS(=O)(=O)Cc1cc(N)ccc1CCNC(=O)O

nearest known ligand 0.38

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 11/20 0.38
MTNR1B P49286 9/20 0.38
NQO2 P16083 5/20 0.38
L3MBTL1 Q9Y468 1/20 0.35
HSP90AA1 P07900 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
DHFR P00374 1/20 0.33
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
FFAR1 O14842 1/20 0.33
EPHX2 P34913 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HSD17B10 Q99714 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
SCHEMBL19742536 0.87 EPHX2 (0.40) L3MBTL1TSHRFFAR1EPHX2NR1H4
SCHEMBL11290858 0.80 TAAR1 (0.41) NQO2SMN1; SMN2TSHRKDM4EHSD17B10
SCHEMBL28872057 0.78 L3MBTL1 (0.39) L3MBTL1TSHRFFAR1
SCHEMBL19742597 0.78 MTNR1A (0.33) MTNR1AMTNR1BNQO2HSP90AA1SMN1; SMN2
SCHEMBL30279896 0.78 MTNR1A (0.33) MTNR1AMTNR1BNQO2HSP90AA1SMN1; SMN2
SCHEMBL19742636 0.78 CYP19A1 (0.34) MTNR1AMTNR1BL3MBTL1SMN1; SMN2TSHR
SCHEMBL1028248 0.76 MAPT (0.35) MTNR1AMTNR1BNQO2SMN1; SMN2TSHR
SCHEMBL19212130 0.76 AKR1B1 (0.44) FFAR1
SCHEMBL6675153 0.75 MTNR1A (0.49) MTNR1AMTNR1B
SCHEMBL30279930 0.74 LMNA (0.36) L3MBTL1HSP90AA1SMN1; SMN2DHFRTSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3474855-B1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS INC (US) 2022-01-26 EP disclosed
EP-3474855-A1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF Polaris Pharmaceuticals, Inc. (US) 2019-05-01 EP disclosed
US-10227344-B2 CK2 inhibitors, compositions and methods thereof POLARIS PHARMACEUTICALS, INC. (US) 2019-03-12 US disclosed
US-20170369489-A1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS 2017-12-28 US disclosed
WO-2017223432-A1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF POLARIS PHARMACEUTICALS (US) 2017-12-28 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 (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-20170369489-A1 CK2 INHIBITORS, COMPOSITIONS AND METHODS THEREOF CSNK1A1, CSNK2A1, CSNK2A3 MTNR1A 850/4885MTNR1B 891/4885NQO2 727/4885
US-10227344-B2 CK2 inhibitors, compositions and methods thereof CSNK1A1, CSNK2A1, CSNK2A3 MTNR1A 850/4885MTNR1B 891/4885NQO2 727/4885

“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.