SCHEMBL2626838

SCHEMBL2626838

c1cc(Cc2cnc[nH]2)c2occc2c1

nearest known ligand 0.60

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ADRA1D P25100 7/20 0.60
▸ ADRA2A P08913 2/20 0.60
▸ ADRA2B P18089 2/20 0.60
▸ ADRA2C P18825 2/20 0.60
▸ ADRA1A P35348 2/20 0.60
▸ ADRA1B P35368 2/20 0.60
▸ HRH3 Q9Y5N1 8/20 0.45
▸ TAAR1 Q96RJ0 1/20 0.45
▸ CYP11B1 P15538 1/20 0.45
▸ CYP11B2 P19099 1/20 0.45
▸ HRH4 Q9H3N8 3/20 0.42
▸ CYP3A4 P08684 1/20 0.41
▸ MAPT P10636 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL31284940 0.79 HRH3 (0.47) ADRA1DADRA2AADRA2BADRA2CADRA1A
SCHEMBL21401254 0.75 ADRA1D (1.00) ADRA1DADRA2AADRA2BADRA2CADRA1A
SCHEMBL955967 0.71 ADRA2A (0.58) ADRA2AADRA2BADRA2CTAAR1
SCHEMBL2105196 0.71 EED (0.39) CYP3A4
SCHEMBL1602646 0.69 EED (0.42) CYP11B1CYP11B2SMN1; SMN2
SCHEMBL2626817 0.69 ADRA1D (0.63) ADRA1DADRA2AADRA2BADRA2CADRA1A
Detomidine SCHEMBL2626815 0.69 ADRA1D (0.58) ADRA1DADRA2AADRA2BADRA2CADRA1A
Detomidine SCHEMBL29833001 0.69 ADRA1D (0.58) ADRA1DADRA2AADRA2BADRA2CADRA1A
SCHEMBL2626853 0.69 HRH3 (0.59) ADRA1DADRA2AADRA2BADRA2CADRA1A
SCHEMBL4403574 0.68 ADRA1D (0.61) ADRA1DADRA2AADRA2BADRA2CADRA1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4729516-A1 SUBSTITUTED IMIDAZOLE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2026-04-22 — — EP claimed
WO-2024260319-A1 SUBSTITUTED IMIDAZOLE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏恩华药业股份有限公司 2024-12-26 — — WO claimed
EP-4729516-A1 SUBSTITUTED IMIDAZOLE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD THEREFOR AND USE THEREOF Jiangsu NHWA Pharmaceutical Co., Ltd (CN) 2026-04-22 — — EP disclosed
WO-2024260319-A1 SUBSTITUTED IMIDAZOLE DERIVATIVE, INTERMEDIATE, PREPARATION METHOD THEREFOR AND USE THEREOF 江苏恩华药业股份有限公司 2024-12-26 — — WO disclosed
US-8158668-B2 Methods for treating CNS disorders with 4-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2012-04-17 — — US disclosed
US-8158668-B2 Methods for treating CNS disorders with 4-imidazole derivatives HOFFMANN-LA ROCHE INC. (US) 2012-04-17 — — US disclosed
US-20070197622-A1 Methods for treating CNS disorders with 4-imidazole derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2007-08-23 — — US disclosed
US-20070197622-A1 Methods for treating CNS disorders with 4-imidazole derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2007-08-23 — — US disclosed
WO-2007085556-A2 USE OF 4-IMIDAZOLE DERIVATIVES FOR CNS DISORDERS F. HOFFMANN-LA ROCHE AG (CH) 2007-08-02 — — 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-20070197622-A1 Methods for treating CNS disorders with 4-imidazole derivatives CRY1, GPR119, MTNR1A ADRA1D 36/4885ADRA2A 116/4885ADRA2B 107/4885

“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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