SCHEMBL17407641

SCHEMBL17407641

Cc1ccc(Cc2nc3c(Cc4ccccc4)[nH]c(-c4ccncc4)cn-3c2=O)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDC7 O00311 3/20 0.43
▸ GSK3B P49841 2/20 0.40
▸ ALKBH3 Q96Q83 1/20 0.36
▸ ALDH1A1 P00352 3/20 0.35
▸ LTB4R Q15722 1/20 0.34
▸ GABRA1 P14867 1/20 0.34
▸ GABRB2 P47870 1/20 0.34
▸ NR1H4 Q96RI1 1/20 0.34
▸ MMP9 P14780 1/20 0.34
▸ MAOA P21397 1/20 0.34
▸ MAOB P27338 1/20 0.34
▸ NPC1 O15118 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ ATM Q13315 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ MAP4K4 O95819 1/20 0.33
▸ FRK P42685 1/20 0.33

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
SCHEMBL17407642 0.94 ALKBH3 (0.38) CDC7ALKBH3ALDH1A1LTB4RGABRA1
SCHEMBL20841748 0.93 ALKBH3 (0.41) CDC7ALKBH3ALDH1A1LTB4RGABRA1
SCHEMBL19206652 0.91 CDC7 (0.45) CDC7GSK3BALDH1A1LTB4RNPC1
SCHEMBL5558105 0.90 CDC7 (0.46) CDC7GSK3BALDH1A1LTB4R
SCHEMBL24329824 0.89 ADORA3 (0.39) ALKBH3ALDH1A1GABRA1GABRB2NR1H4
SCHEMBL10196888 0.89 ABCB1 (0.39) CDC7ALKBH3ALDH1A1GABRA1GABRB2
SCHEMBL20841761 0.89 ABCB1 (0.39) CDC7ALKBH3ALDH1A1GABRA1GABRB2
SCHEMBL13484442 0.87 ALDH1A1 (0.42) ALDH1A1NPC1POLBRAB9AMAPT
SCHEMBL17299341 0.87 ALKBH3 (0.38) ALKBH3ALDH1A1GABRA1GABRB2MMP9
SCHEMBL492636 0.87 LTB4R (0.41) CDC7ALKBH3ALDH1A1LTB4RPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9938564-B2 Substituted imidazo[1,2-a]pyrazines for use in bioluminogenic methods PROMEGA CORPORATION (US) 2018-04-10 — — US disclosed
US-20160002703-A1 IMIDAZO[1,2-alpha]PYRAZINE DERIVATIVES JPMORGAN CHASE BANK, N.A., AS COLLATERAL AGENT 2016-01-07 — — 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 (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-20160002703-A1 IMIDAZO[1,2-alpha]PYRAZINE DERIVATIVES GLB1, NISCH, BOLA2; BOLA2B CDC7 3783/4885GSK3B 4095/4885ALKBH3 4617/4885

“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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