SCHEMBL2867642

SCHEMBL2867642

O=C(Cc1cccs1)Nc1cc2c(-c3cc4ccccc4s3)n[nH]c2cc1F

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKA O14965 6/20 0.49
AURKB Q96GD4 6/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
MAPK10 P53779 1/20 0.45
TTK P33981 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA5A P35218 1/20 0.44
CA7 P43166 1/20 0.44
CA13 Q8N1Q1 1/20 0.44
CA5B Q9Y2D0 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
CHEK1 O14757 1/20 0.44
DAPK3 O43293 1/20 0.44
PRKD3 O94806 1/20 0.44
LMNA P02545 1/20 0.44
NTRK1 P04629 1/20 0.44
FYN P06241 1/20 0.44

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
SCHEMBL2868770 0.85 AURKA (0.51) AURKAAURKBMEN1KMT2ATTK
SCHEMBL2862233 0.84 MEN1 (0.45) AURKAAURKBMEN1KMT2AMAPK10
SCHEMBL2862092 0.82 MAPK10 (0.49) AURKAMAPK10MAPKAPK2
SCHEMBL2866702 0.81 MAPK10 (0.44) MAPK10SMN1; SMN2KDM4EMAPKAPK2
SCHEMBL4329381 0.79 MAPK10 (0.59) KMT2AMAPK10NPC1RAB9ANTRK1
SCHEMBL2871502 0.79 SMN1; SMN2 (0.46) AURKAAURKBMEN1KMT2AMAPK10
SCHEMBL4337651 0.79 MAPK10 (0.46) MEN1KMT2AMAPK10NPC1RAB9A
SCHEMBL2855817 0.76 MAPK10 (0.58) AURKAAURKBMAPK10TTKNPC1
SCHEMBL4136557 0.76 AURKA (0.67) AURKAAURKBMEN1KMT2ACA1
SCHEMBL4136551 0.76 AURKA (0.67) AURKAAURKBMEN1KMT2ACA1

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 12 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-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
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 AURKA 502/4885AURKB 520/4885MEN1 3782/4885
US-20040127538-A1 Novel 1h-indazole compound MAPK1, MAPK14, MAPK3 AURKA 779/4885AURKB 756/4885MEN1 4417/4885
US-20050282880-A1 Novel 1H-indazole compounds MAPK1, MAPK3, MAPK13 AURKA 502/4885AURKB 520/4885MEN1 3782/4885

“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.