SCHEMBL18438040

SCHEMBL18438040

c1ccc(-c2ccc3[nH]nc(-c4nc5ccccc5[nH]4)c3n2)nc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ METAP2 P50579 7/20 0.59
▸ METAP1 P53582 6/20 0.59
▸ NPC1 O15118 2/20 0.59
▸ PKM P14618 2/20 0.59
▸ RAB9A P51151 2/20 0.59
▸ SMN1; SMN2 Q16637 2/20 0.59
▸ LMNA P02545 1/20 0.59
▸ HPGD P15428 1/20 0.59
▸ MTOR P42345 1/20 0.59
▸ CLK2 P49760 6/20 0.55
▸ CLK3 P49761 5/20 0.55
▸ DYRK1A Q13627 5/20 0.55
▸ FGFR1 P11362 1/20 0.53
▸ FLT1 P17948 1/20 0.53
▸ PDPK1 O15530 2/20 0.52
▸ WNT1 P04628 1/20 0.50
▸ TGFBR1 P36897 1/20 0.50
▸ LRRK2 Q5S007 1/20 0.46
▸ CHEK1 O14757 1/20 0.46
▸ CBFB Q13951 4/20 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
SCHEMBL18449892 0.88 CLK2 (0.59) METAP2METAP1NPC1PKMRAB9A
SCHEMBL18454489 0.88 CLK2 (0.53) METAP2METAP1NPC1PKMRAB9A
SCHEMBL18438101 0.87 METAP2 (0.62) METAP2METAP1NPC1PKMRAB9A
SCHEMBL4042304 0.85 FGFR1 (0.63) METAP2METAP1NPC1PKMRAB9A
SCHEMBL18438773 0.84 CLK2 (0.61) CLK2CLK3DYRK1AWNT1TGFBR1
SCHEMBL18450642 0.84 CLK2 (0.61) NPC1RAB9ASMN1; SMN2HPGDCLK2
SCHEMBL18438234 0.82 CLK2 (0.67) HPGDCLK2CLK3DYRK1AFGFR1
SCHEMBL18438342 0.81 CLK2 (0.83) CLK2CLK3DYRK1AFGFR1FLT1
SCHEMBL18445148 0.81 ITK (0.60) CLK2CLK3DYRK1ALRRK2CHEK1
SCHEMBL18439858 0.80 CLK2 (0.65) CLK2CLK3DYRK1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10392383-B2 3-(1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[4,3-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-08-27 — — US claimed
WO-2017023989-A1 3-(1H-BENZO[D]IMIDAZOL-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO claimed
US-10392383-B2 3-(1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[4,3-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-08-27 — — US disclosed
US-10392383-B2 3-(1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[4,3-b]pyridines and therapeutic uses thereof SAMUMED, LLC (US) 2019-08-27 — — US disclosed
WO-2017023989-A1 3-(1H-BENZO[D]IMIDAZOL-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — WO disclosed
WO-2017023989-A1 3-(1H-BENZO[D]IMIDAZOL-2-YL)-1H-PYRAZOLO[4,3-B]PYRIDINES AND THERAPEUTIC USES THEREOF SAMUMED, LLC. (US) 2017-02-09 — — 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-10392383-B2 3-(1H-benzo[d]imidazol-2-yl)-1H-pyrazolo[4,3-b]pyridines and therapeutic uses thereof WNT1, WNT3, WNT3A METAP2 4603/4885METAP1 4362/4885NPC1 3609/4885

“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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