SCHEMBL2863052

SCHEMBL2863052

O=C(O)c1ccc2[nH]nc(-c3cccnc3)c2c1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP2K4 P45985 5/20 0.62
IDO1 P14902 1/20 0.60
LRRK2 Q5S007 1/20 0.60
PIM1 P11309 6/20 0.58
MAPK1 P28482 4/20 0.57
MAPKAPK3 Q16644 3/20 0.57
MAPK6 Q16659 3/20 0.57
KMO O15229 1/20 0.56
PIM3 Q86V86 1/20 0.56
PIM2 Q9P1W9 1/20 0.56
MKNK1 Q9BUB5 1/20 0.55
MKNK2 Q9HBH9 1/20 0.55
CDK7 P50613 1/20 0.54
AXL P30530 1/20 0.53
TTK P33981 1/20 0.53
NTRK1 P04629 1/20 0.52
IP6K1 Q92551 1/20 0.51
IP6K3 Q96PC2 1/20 0.51
IP6K2 Q9UHH9 1/20 0.51
MAPK3 P27361 1/20 0.49

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
SCHEMBL2866791 0.87 MAP2K4 (0.69) MAP2K4IDO1MAPK1MAPKAPK3MAPK6
SCHEMBL2864413 0.84 MAP2K4 (0.60) MAP2K4IDO1LRRK2PIM1PIM3
SCHEMBL14872686 0.82 MAPK1 (0.65) MAP2K4MAPK1MAPKAPK3MAPK6MKNK1
SCHEMBL2858476 0.80 MAP2K4 (0.68) MAP2K4MAPK1MAPKAPK3MAPK6TTK
SCHEMBL2861623 0.80 MAPK1 (0.63) MAP2K4MAPK1MAPKAPK3MAPK6MAPK3
SCHEMBL29172495 0.79 CDK7 (0.67) MAP2K4IDO1LRRK2CDK7NTRK1
SCHEMBL30725877 0.79 CDK7 (0.67) MAP2K4IDO1LRRK2CDK7NTRK1
SCHEMBL2868589 0.78 MAP2K4 (0.69) MAP2K4MAPK1MAPKAPK3MAPK6TTK
Ethylene SCHEMBL27536148 0.77 MAP2K4 (0.65) MAP2K4MAPK1MAPKAPK3MAPK6TTK
SCHEMBL2862381 0.77 MAP2K4 (0.70) MAP2K4MAPK1MAPKAPK3MAPK6MAPK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
US-7776890-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-08-17 US disclosed
EP-1380576-B1 1H-INDAZOLE COMPOUNDS INHIBITING JNK EISAI R&D MAN CO LTD (JP) 2009-11-25 EP disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-20090203691-A1 Novel 1H-indazole compounds OINUMA HITOSHI 2009-08-13 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
US-7541376-B2 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-06-02 US disclosed
CN-1300116-C 1H-indazole compounds EISAI CO LTD (JP) 2007-02-14 CN disclosed
US-6982274-B2 1H-indazole compound EISAI CO., LTD. (JP) 2006-01-03 US disclosed
US-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 US disclosed
CN-1512987-A Novel 1H-indazole compound ������������ʽ���� 2004-07-14 CN disclosed
US-20040127538-A1 Novel 1h-indazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-07-01 US disclosed
EP-1380576-A1 NOVEL 1H-INDAZOLE COMPOUND Eisai Co., Ltd. (JP) 2004-01-14 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 (3 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-20090203691-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MAP2K4 61/4885IDO1 784/4885LRRK2 282/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 MAP2K4 53/4885IDO1 959/4885LRRK2 817/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 MAP2K4 61/4885IDO1 784/4885LRRK2 282/4885

“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.