SCHEMBL20247408

SCHEMBL20247408

Cc1n[nH]c2ncc(I)nc12

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ MAPK1 P28482 2/20 0.33
▸ PDPK1 O15530 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
SCHEMBL18357966 0.80 PDK2 (0.36) MAPK1PDPK1
SCHEMBL3954043 0.77 MAPK1 (0.44) MAPK1PDPK1
SCHEMBL12467739 0.77 DYRK1A (0.37) MAPK1PDPK1
SCHEMBL23962575 0.74 KDM4E (0.39) MAPK1PDPK1
SCHEMBL3950985 0.73 PDPK1 (0.38) MAPK1PDPK1
SCHEMBL19260963 0.72 JAK2 (0.43) MAPK1
SCHEMBL23169547 0.69 ALDH1A1 (0.37) MAPK1PDPK1
SCHEMBL24121831 0.69 YTHDC1 (0.33) —
SCHEMBL24121832 0.68 PDPK1 (0.35) MAPK1PDPK1
SCHEMBL23229339 0.68 DYRK1A (0.36) PDPK1

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
WO-2021254493-A1 CYCLIC COMPOUND HAVING ANTI-TUMOR ACTIVITY AND USE THEREOF 上海翊石医药科技有限公司 2021-12-23 — — WO disclosed
EP-3333157-B1 VINYL COMPOUNDS AS FGFR AND VEGFR INHIBITORS HARBIN ZHENBAO PHARMACEUTICAL CO LTD (CN) 2020-12-23 — — EP disclosed
EP-3333157-A1 VINYL COMPOUNDS AS FGFR AND VEGFR INHIBITORS Harbin Zhenbao Pharmaceutical Co., Ltd. (CN) 2018-06-13 — — EP disclosed
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