SCHEMBL2381791

SCHEMBL2381791

O=C(Nc1ccc2cc(OS(=O)(=O)C(F)(F)F)ccc2c1)c1cccs1

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 10/20 0.53
▸ NPC1 O15118 8/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.53
▸ TP53 P04637 2/20 0.53
▸ KMT2A Q03164 9/20 0.52
▸ MEN1 O00255 8/20 0.52
▸ TDP1 Q9NUW8 2/20 0.52
▸ LMNA P02545 2/20 0.51
▸ MAPT P10636 1/20 0.51
▸ KCNK3 O14649 1/20 0.49
▸ KCNK9 Q9NPC2 1/20 0.49
▸ TRPA1 O75762 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48
▸ GAA P10253 1/20 0.48
▸ CASP3 P42574 1/20 0.48
▸ SENP8 Q96LD8 1/20 0.48
▸ SENP7 Q9BQF6 1/20 0.48
▸ SENP6 Q9GZR1 1/20 0.48

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
SCHEMBL2379733 0.79 KCNK3 (0.50) RAB9ANPC1KMT2AKCNK3KCNK9
SCHEMBL2380329 0.76 NPC1 (0.64) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL5991688 0.72 RAB9A (0.80) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL20353537 0.72 ALDH1A1 (0.65) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL15434968 0.72 LMNA (0.74) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL4056753 0.71 CA1 (0.51) SMN1; SMN2TDP1LMNA
SCHEMBL28148837 0.71 RAB9A (0.77) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL833815 0.71 SMN1; SMN2 (0.65) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL23011772 0.70 KCNK3 (0.82) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL31073631 0.70 KMT2A (0.65) RAB9ANPC1SMN1; SMN2KMT2AMEN1

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 4 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
EP-1896461-A2 BIS-ARYL KINASE INHIBITORS AND THEIR USE IN THE TREATMENT OF INFLAMMATION, ANGIOGENESIS AND CANCER Amgen Inc. (US) 2008-03-12 — — EP 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 RAB9A 1962/4885NPC1 1163/4885SMN1; SMN2 3141/4885

“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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