SCHEMBL2380778

SCHEMBL2380778

O=C1Cc2cc(-c3ccc4cc(NC(=O)c5ccsc5)ccc4c3)ccc2N1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TLK2 Q86UE8 1/20 0.48
▸ PDE3B Q13370 1/20 0.45
▸ PDE3A Q14432 1/20 0.45
▸ SMYD3 Q9H7B4 2/20 0.44
▸ KCNK3 O14649 1/20 0.43
▸ KCNK9 Q9NPC2 1/20 0.43
▸ MAPK14 Q16539 4/20 0.42
▸ HPGD P15428 1/20 0.41
▸ LRRK2 Q5S007 1/20 0.41
▸ CRBN Q96SW2 2/20 0.41
▸ NPC1 O15118 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ PGR P06401 1/20 0.40
▸ HDAC3 O15379 1/20 0.40
▸ KMT2A Q03164 1/20 0.40

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
SCHEMBL2382466 0.92 CRBN (0.51) TLK2SMYD3KCNK3KCNK9MAPK14
SCHEMBL2380306 0.82 MAPK14 (0.49) KCNK3KCNK9MAPK14HPGDLRRK2
SCHEMBL14604838 0.78 KCNK3 (0.44) KCNK3KCNK9MAPK14HPGDNPC1
SCHEMBL2382186 0.77 ESR1 (0.53) KCNK3KCNK9MAPK14HPGDNPC1
SCHEMBL2382404 0.75 NPC1 (0.60) NPC1RAB9AKMT2A
SCHEMBL2382379 0.75 NPC1 (0.58) KCNK3KCNK9HPGDNPC1RAB9A
SCHEMBL2380312 0.73 CDK7 (0.45) KCNK3KCNK9MAPK14HPGDLRRK2
SCHEMBL14073741 0.73 CYP3A4 (0.57) KCNK3KCNK9MAPK14HPGDNPC1
SCHEMBL9837319 0.72 SMYD3 (0.49) PDE3BPDE3ASMYD3HDAC3
SCHEMBL5842454 0.72 TLK2 (0.57) TLK2SMYD3KCNK3KCNK9LRRK2

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-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-8017601-B2 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2011-09-13 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
US-20070054903-A1 Bis-aryl kinase inhibitors and method AMGEN INC. (US) 2007-03-08 — — US disclosed
WO-2007005668-A2 BIS-ARYL KINASE INHIBITORS AND THEIR USE IN THE TREATMENT OF INFLAMMATION, ANGIOGENESIS AND CANCER AMGEN INC. (US) 2007-01-11 — — WO 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 (1 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-20070054903-A1 Bis-aryl kinase inhibitors and method HGF, MET, BLK TLK2 679/4885PDE3B 1990/4885PDE3A 2408/4885

“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.

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