SCHEMBL20183391

SCHEMBL20183391

C[C@H](c1ccccc1)N1C/C(=N/O)C(C)(C)C1=O

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.42
HSD11B1 P28845 2/20 0.39
MAPK1 P28482 7/20 0.38
METAP2 P50579 2/20 0.38
CYP2D6 P10635 1/20 0.38
P2RX7 Q99572 1/20 0.35

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
SCHEMBL3189312 1.00 KMT2A (0.42) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL3189307 1.00 KMT2A (0.42) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL20183392 1.00 KMT2A (0.42) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL769859 0.84 KMT2A (0.41) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL785824 0.84 KMT2A (0.41) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL769861 0.84 KMT2A (0.41) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL769860 0.84 KMT2A (0.41) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL13484126 0.82 HSD11B1 (0.39) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL3203744 0.82 HSD11B1 (0.39) KMT2AHSD11B1MAPK1METAP2CYP2D6
SCHEMBL3195911 0.82 HSD11B1 (0.39) KMT2AHSD11B1MAPK1METAP2CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof YANG JI CHEMICAL CO., LTD. (KR) 2019-09-10 US disclosed
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF YANG JI CHEMICAL CO., LTD. (KR) 2018-08-23 US disclosed
EP-3327021-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF Yangji Chemical Co., Ltd. (KR) 2018-05-30 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 (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-10407430-B2 Janus kinase 1 selective inhibitor and pharmaceutical use thereof JAK1, JAK2, JAK3 KMT2A 1054/4885HSD11B1 988/4885MAPK1 13/4885
US-20180237440-A1 JANUS KINASE 1 SELECTIVE INHIBITOR AND PHARMACEUTICAL USE THEREOF JAK1, JAK2, JAK3 KMT2A 2046/4885HSD11B1 2049/4885MAPK1 86/4885

“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.