SCHEMBL22155013

SCHEMBL22155013

COB(O)c1ccc(C#N)cc1C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AR P10275 5/20 0.43
ENPP2 Q13822 2/20 0.38
CYP11B2 P19099 6/20 0.38
CYP11B1 P15538 5/20 0.38
ALDH1A1 P00352 1/20 0.38
CYP2A6 P11509 1/20 0.38
MRGPRX4 Q96LA9 1/20 0.35
OXTR P30559 1/20 0.33
ESRRA P11474 1/20 0.33
CA12 O43570 1/20 0.33
CA2 P00918 1/20 0.33
CA3 P07451 1/20 0.33
CA6 P23280 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
EGLN2 Q96KS0 1/20 0.33
SNCA P37840 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
SCHEMBL29954967 0.85 ENPP2 (0.48) ARENPP2CYP11B2CYP11B1ALDH1A1
SCHEMBL1277292 0.85 ENPP2 (0.48) ARENPP2CYP11B2CYP11B1ALDH1A1
SCHEMBL15159875 0.84 PARP15 (0.42) ARENPP2
SCHEMBL15367231 0.80 AR (0.34) ARENPP2CYP11B2CYP11B1ALDH1A1
SCHEMBL31555022 0.73 ENPP2 (0.48) ARENPP2CYP11B2CYP11B1ALDH1A1
SCHEMBL21133795 0.73 ENPP2 (0.59) ENPP2ALDH1A1CYP2A6CA12CA2
SCHEMBL1822394 0.73 ENPP2 (0.48) ARENPP2CYP11B2CYP11B1ALDH1A1
SCHEMBL28267893 0.73 ESR2 (0.38) ALDH1A1CA12CA2CA9CA14
SCHEMBL15010996 0.73 AR (0.51) ARENPP2CYP11B2CYP11B1EGLN2
SCHEMBL29954436 0.73 AR (0.51) ARENPP2CYP11B2CYP11B1EGLN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11084808-B2 Oxopicolinamide derivative, preparation method therefor and pharmaceutical use thereof JIANGSU HENGRUI MEDICINE CO., LTD. (CN) 2021-08-10 US disclosed
US-20200199115-A1 OXOPICOLINAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) 2020-06-25 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 (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-20200199115-A1 OXOPICOLINAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF F11, F2, F7 AR 3919/4885ENPP2 152/4885CYP11B2 112/4885
US-11084808-B2 Oxopicolinamide derivative, preparation method therefor and pharmaceutical use thereof F11, F2, F7 AR 3633/4885ENPP2 136/4885CYP11B2 157/4885

“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.