SCHEMBL20738658

SCHEMBL20738658

CCNC(C)(CO)c1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 2/20 0.55
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
RECQL P46063 1/20 0.39
CYP2C19 P33261 1/20 0.38
HIF1A Q16665 1/20 0.38
MAPK1 P28482 2/20 0.38
ALDH1A1 P00352 2/20 0.38
TAAR1 Q96RJ0 1/20 0.38
ALOX15 P16050 1/20 0.38
HDAC3 O15379 1/20 0.37
HDAC4 P56524 1/20 0.37
HDAC1 Q13547 1/20 0.37
HDAC7 Q8WUI4 1/20 0.37
HDAC2 Q92769 1/20 0.37
HDAC10 Q969S8 1/20 0.37
HDAC11 Q96DB2 1/20 0.37
HDAC8 Q9BY41 1/20 0.37
HDAC6 Q9UBN7 1/20 0.37
HDAC9 Q9UKV0 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
SCHEMBL22558396 0.83 KCNN4 (0.59) KCNN4CYP3A4CYP1A2RECQLCYP2C19
SCHEMBL18765696 0.79 KIF11 (0.56) KCNN4CYP3A4CYP1A2RECQLCYP2C19
SCHEMBL28312942 0.78 KCNN4 (0.57) KCNN4CYP3A4CYP1A2CYP2C19HIF1A
SCHEMBL27776663 0.75 KCNN4 (0.59) KCNN4CYP3A4CYP1A2CYP2C19HIF1A
SCHEMBL26907235 0.74 CYP3A4 (0.49) KCNN4CYP3A4CYP1A2RECQLCYP2C19
SCHEMBL469181 0.74 KCNN4 (0.64) KCNN4CYP3A4CYP2C19HIF1AMAPK1
SCHEMBL28798433 0.74 KCNN4 (0.64) KCNN4CYP3A4CYP2C19HIF1AMAPK1
SCHEMBL24015529 0.73 CYP3A4 (0.47) KCNN4CYP3A4CYP1A2RECQLCYP2C19
SCHEMBL24015881 0.73 CYP3A4 (0.47) KCNN4CYP3A4CYP1A2RECQLCYP2C19
Hydrochloric Acid SCHEMBL9957339 0.72 KCNN4 (0.61) KCNN4CYP2C19HIF1AMAPK1ALDH1A1

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
US-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2023-01-19 US disclosed
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2021-05-11 US disclosed
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-10-29 US disclosed
US-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2019-02-14 US disclosed
CN-1326457-A 4-aminopyrrolopyrimidines as kinase inhibitors BASF AG (DE) 2001-12-12 CN 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 (4 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-20230019032-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 KCNN4 1687/4885CYP3A4 2243/4885CYP1A2 1393/4885
US-20190047990-A1 BENZOLACTAM COMPOUNDS AS PROTEIN KINASE INHIBITORS MAPK1, ALK, MAP3K1 KCNN4 1687/4885CYP3A4 2243/4885CYP1A2 1393/4885
US-11001575-B1 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 KCNN4 1709/4885CYP3A4 2361/4885CYP1A2 1488/4885
US-10457669-B2 Benzolactam compounds as protein kinase inhibitors MAPK1, ALK, MAP3K1 KCNN4 1687/4885CYP3A4 2243/4885CYP1A2 1393/4885

“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.