SCHEMBL10050501

SCHEMBL10050501

N#CCCCOc1ccc(-c2c3nc(c(-c4ccncc4)c4ccc([nH]4)c(-c4ccc(OCCCN5C(=O)c6ccccc6C5=O)cc4)c4nc(c(-c5ccncc5)c5ccc2[nH]5)C=C4)C=C3)cc1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.44
▸ MAPT P10636 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ TOP1 P11387 1/20 0.41
▸ BACE1 P56817 7/20 0.39
▸ HPGD P15428 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ PDE3B Q13370 1/20 0.38
▸ PDE3A Q14432 1/20 0.38
▸ P2RY12 Q9H244 1/20 0.38
▸ NPC1 O15118 1/20 0.38

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
SCHEMBL10050486 0.93 RAB9A (0.51) RAB9AMAPTSMN1; SMN2TOP1BACE1
SCHEMBL14528653 0.88 RAB9A (0.46) RAB9AMAPTSMN1; SMN2TOP1BACE1
SCHEMBL10050504 0.88 RAB9A (0.52) RAB9AMAPTSMN1; SMN2TOP1BACE1
SCHEMBL10075064 0.87 RAB9A (0.49) RAB9AMAPTSMN1; SMN2BACE1HPGD
SCHEMBL10074756 0.83 RAB9A (0.50) RAB9AMAPTSMN1; SMN2BACE1HPGD
SCHEMBL10050498 0.81 RAB9A (0.43) RAB9AMAPTSMN1; SMN2BACE1HPGD
SCHEMBL8908471 0.78 RAB9A (0.52) RAB9AMAPTSMN1; SMN2BACE1HPGD
SCHEMBL10050497 0.78 RAB9A (0.44) RAB9AMAPTSMN1; SMN2BACE1HPGD
SCHEMBL9230080 0.73 TOP1 (0.60) RAB9AMAPTTOP1NPC1
SCHEMBL2549051 0.73 TOP1 (0.60) RAB9AMAPTTOP1NPC1

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-8092661-B2 Electropolymerisable monomers, soluble in an aqueous solution and comprising a metalloporphyrin BIOMERIEUX (FR) 2012-01-10 — — US disclosed
US-8092661-B2 Electropolymerisable monomers, soluble in an aqueous solution and comprising a metalloporphyrin BIOMERIEUX (FR) 2012-01-10 — — US disclosed
US-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin BIOMERIEUX (FR) 2009-12-24 — — US disclosed
US-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin BIOMERIEUX (FR) 2009-12-24 — — 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-20090314660-A1 Novel Electropolymerisable Monomers, Soluble in an Aqueous Solution and Comprising a Metalloporphyrin EPS15, PPOX, ACR RAB9A 4754/4885MAPT 2894/4885SMN1; SMN2 4294/4885

“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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