SCHEMBL7854448

SCHEMBL7854448

c1ccc2[nH]c(CCCc3nc4ccccc4[nH]3)nc2c1

nearest known ligand 0.92

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.92
NPC1 O15118 1/20 0.70
RAB9A P51151 1/20 0.70
DDAH1 O94760 1/20 0.66
CHRM1 P11229 1/20 0.64
PDE10A Q9Y233 2/20 0.62
GAA P10253 1/20 0.61
BCHE P06276 1/20 0.59
KMT2A Q03164 1/20 0.58
PKM P14618 1/20 0.58

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
SCHEMBL7006523 0.96 POLB (1.00) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL2331252 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL7856315 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL7856311 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL7854826 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL30701864 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL30701863 0.94 POLB (0.96) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL230157 0.91 POLB (0.84) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL6753946 0.91 NPC1 (0.81) POLBNPC1RAB9ADDAH1CHRM1
SCHEMBL856769 0.89 POLB (0.79) POLBNPC1RAB9ADDAH1CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108822130-A Benzimidazole ring kind and the preparation method and application thereof 天津师范大学 2018-11-16 CN claimed
US-20240174583-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES DOW TECHNOLOGY INVESTMENTS LLC (US) 2024-05-30 US disclosed
EP-4347544-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES Dow Technology Investments LLC (US) 2024-04-10 EP disclosed
EP-2970074-B1 HYDROFORMYLATION PROVESS USING A HETEREOCYCLIC AGENT AS CATALYTIC STABILIZING AGENT DOW TECHNOLOGY INVESTMENTS LLC (US) 2019-04-24 EP disclosed
CN-108822130-A Benzimidazole ring kind and the preparation method and application thereof 天津师范大学 2018-11-16 CN disclosed
US-9573870-B2 Hetereocyclic agent as catalytic stabilizing agent in a hydroformylation process DOW TECHNOLOGY INVESTMENTS LLC (US) 2017-02-21 US disclosed
EP-2970074-A1 HETEREOCYCLIC AGENT AS CATALYTIC STABILIZING AGENT IN A HYDROFORMYLATION PROCESS Dow Technology Investments LLC (US) 2016-01-20 EP disclosed
US-20150376101-A1 HETEREOCYCLIC AGENT AS CATALYTIC STABILIZING AGENT IN A HYDROFORMYLATION PROCESS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY LLC 2015-12-31 US disclosed
WO-2014149915-A1 HETEREOCYCLIC AGENT AS CATALYTIC STABILIZING AGENT IN A HYDROFORMYLATION PROCESS DOW TECHNOLOGY INVESTMENTS LLC (US) 2014-09-25 WO disclosed
EP-0873292-B1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEM PLASTIC (US) 2001-12-19 EP disclosed
EP-0873292-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-10-28 EP disclosed
US-5731472-A HETEROCYCLIC NITROGEN COMPOUNDS UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1998-03-24 US disclosed
WO-1997020798-A1 IMPROVED METAL-LIGAND COMPLEX CATALYZED PROCESSES UNION CARBIDE CHEMICALS & PLASTICS TECHNOLOGY CORPORATION (US) 1997-06-12 WO disclosed
EP-0268553-B1 PHOTOSENSITIVE MIXTURES CIBA-GEIGY AG (CH) 1991-09-11 EP disclosed
US-4835085-A 1,2-Naphthoquinone diazide sulfonyl ester compound with linking benzotriazole groups and light-sensitive composition with compound CIBA-GEIGY CORPORATION (US) 1989-05-30 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 (2 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-20150376101-A1 HETEREOCYCLIC AGENT AS CATALYTIC STABILIZING AGENT IN A HYDROFORMYLATION PROCESS NUDT1, CAT, HRAS POLB 337/4885NPC1 4091/4885RAB9A 2488/4885
US-20240174583-A1 PROCESSES FOR THE VAPOR PHASE HYDROGENATION OF ALDEHYDES ADH1C, ADH5, ALDH2 POLB 32/4885NPC1 4654/4885RAB9A 2415/4885

“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.