SCHEMBL4331810

SCHEMBL4331810

CCOCCNC(=O)c1ccc2[nH]nc(-c3ccc4ccccc4c3)c2c1OC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 2/20 0.42
CDK4 P11802 1/20 0.42
CCNA2 P20248 1/20 0.42
CCND1 P24385 1/20 0.42
CDK2 P24941 1/20 0.42
CCND3 P30281 1/20 0.42
MAPK1 P28482 4/20 0.41
JAK2 O60674 1/20 0.39
JAK3 P52333 1/20 0.39
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
DRD2 P14416 1/20 0.39
DRD3 P35462 1/20 0.39
CASR P41180 3/20 0.39
LMNA P02545 1/20 0.38
ABL1 P00519 1/20 0.38
BCR P11274 1/20 0.38
TRPA1 O75762 1/20 0.37
SMN1; SMN2 Q16637 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
SCHEMBL13635355 0.89 KDM4E (0.42) KDRCDK4CCNA2CCND1CDK2
SCHEMBL13198250 0.86 HDAC6 (0.50) KDRCDK4CCNA2CCND1CDK2
SCHEMBL4348178 0.86 LMNA (0.45) KDRCDK4CCNA2CCND1CDK2
SCHEMBL4336829 0.83 KDM4E (0.43) MAPK1JAK2JAK3KDM4EALDH1A1
SCHEMBL4332920 0.83 JAK2 (0.42) MAPK1JAK2JAK3KDM4EALDH1A1
SCHEMBL4334496 0.83 MEN1 (0.41) KDRCDK4CCNA2CCND1CDK2
SCHEMBL2864362 0.83 GSK3B (0.44) KDRCDK4CCNA2CCND1CDK2
SCHEMBL4335936 0.83 BRD4 (0.47) KDRCDK4CCNA2CCND1CDK2
SCHEMBL2864594 0.81 KDR (0.47) KDRCDK4CCNA2CCND1CDK2
SCHEMBL2856935 0.81 SMN1; SMN2 (0.54) KDM4EALDH1A1HPGDSMN1; SMN2

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 7 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-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-20050282880-A1 Novel 1H-indazole compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2005-12-22 US disclosed
US-20040127538-A1 Novel 1h-indazole compound EISAI R&D MANAGEMENT CO., LTD. (JP) 2004-07-01 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 (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 KDR 2411/4885CDK4 103/4885CCNA2 398/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 KDR 3273/4885CDK4 165/4885CCNA2 1567/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 KDR 2411/4885CDK4 103/4885CCNA2 398/4885

“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.