SCHEMBL19749938

SCHEMBL19749938

O=C1N(Cc2nc3ccccc3[nH]2)c2ccccc2C12CC2

nearest known ligand 0.51

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NPY5R Q15761 1/20 0.51
HTT P42858 1/20 0.47
PDE10A Q9Y233 2/20 0.47
DRD4 P21917 9/20 0.46
DRD2 P14416 2/20 0.46
HPGD P15428 1/20 0.45
DDAH1 O94760 1/20 0.41
POLB P06746 1/20 0.41
OPRM1 P35372 1/20 0.41
OPRK1 P41145 1/20 0.41
OPRL1 P41146 1/20 0.41
PKM P14618 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
SCHEMBL23100937 0.78 HTT (0.44) NPY5RHTTPDE10ADRD4DRD2
SCHEMBL18138868 0.78 TNKS (0.48) OPRM1OPRK1OPRL1
SCHEMBL16618821 0.70 CNR1 (0.54) DRD4POLBOPRM1OPRK1OPRL1
SCHEMBL17781438 0.69 PDE10A (0.41) HTTPDE10ADRD4DRD2HPGD
SCHEMBL7745407 0.69 PDE10A (0.53) NPY5RHTTPDE10ADRD4DRD2
SCHEMBL5157052 0.68 HTT (0.84) HTTDRD4DRD2HPGDOPRK1
SCHEMBL3178585 0.68 OPRL1 (0.59) OPRM1OPRK1OPRL1
SCHEMBL10518420 0.67 OPRL1 (0.49) OPRM1OPRK1OPRL1
SCHEMBL16812348 0.67 OPRL1 (0.48) OPRM1OPRK1OPRL1
SCHEMBL30181583 0.67 OPRL1 (0.45) OPRM1OPRK1OPRL1

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-10030029-B2 Imidazole derivative used as antiviral agent and use thereof in preparation of medicament SHANDONG DANHONG PHARMACEUTICAL CO., LTD. (CN) 2018-07-24 US disclosed
US-9850251-B2 Imidazole derivative used as antiviral agent and use therof in preparation of medicament SHANDONG DANHONG PHARMACEUTICAL CO., LTD. (CN) 2017-12-26 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-10030029-B2 Imidazole derivative used as antiviral agent and use thereof in preparation of medicament MAVS, ZC3HAV1, SARS1 NPY5R 4753/4885HTT 4491/4885PDE10A 3853/4885

“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.