SCHEMBL7093035

SCHEMBL7093035

CCc1cc(N)cc2nc[nH]c12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.39
PRKCI P41743 1/20 0.38
PARP1 P09874 1/20 0.38
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
RAD52 P43351 1/20 0.37
BLM P54132 2/20 0.36
ALDH1A1 P00352 1/20 0.36
APEX1 P27695 1/20 0.36
RECQL P46063 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ADORA2A P29274 9/20 0.36
ADORA2B P29275 6/20 0.36
ABL1 P00519 1/20 0.35
RIN1 Q13671 1/20 0.35
PDE4A P27815 8/20 0.35
PDE4B Q07343 8/20 0.35
PDE4C Q08493 8/20 0.35
PDE4D Q08499 8/20 0.35
NOS3 P29474 1/20 0.34

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
SCHEMBL7091970 0.83 CDK1 (0.38) PRKCIMAPTADORA2AADORA2BPDE4A
SCHEMBL2915006 0.82 PRKCI (0.38) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL9222057 0.80 NPC1 (0.35) PARP1MAPTKDM4EBLMALDH1A1
SCHEMBL7090538 0.76 PRKCI (0.41) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL28871077 0.75 ALDH1A1 (0.47) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL25397744 0.75 CDK1 (0.35) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL3071570 0.72 PRKCI (0.41) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL7028875 0.72 PRKCI (0.41) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL7035006 0.72 PRKCI (0.41) PRKCIPARP1MAPTKDM4ERAD52
SCHEMBL7032609 0.72 PRKCI (0.41) PRKCIPARP1MAPTKDM4ERAD52

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20030181730-A1 Novel benzimidazole derivatives SYNAPTIC PHARMACEUTICAL CORPORATION 2003-09-25 US disclosed
US-20030022927-A1 Novel benzimidazole derivatives SYNAPTIC PHARMACEUTICAL CORPORATION 2003-01-30 US disclosed
US-6495583-B1 DRUG FOR TREATING AN ALPHA-2 ADRENERGIC RECEPTOR ASSOCIATED DISORDER, NASAL CONGENSTION AND ALLEVIATING PAIN SYNAPTIC PHARMACEUTICAL CORPORATION 2002-12-17 US disclosed
US-6436982-B1 USEFUL AS ANALGESIC, SEDATIVE OR ANAESTHETIC AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2002-08-20 US disclosed
US-20020072536-A1 Novel benzimidazole derivatives SYNAPTIC PHARMACEUTICAL CORPORATION 2002-06-13 US disclosed
US-6403626-B1 USEFUL AS ANALGESIC, SEDATIVE OR ANAESTHETIC AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2002-06-11 US disclosed
US-20020065307-A1 Novel benzimidazole derivatives SYNAPTIC PHARMACEUTICAL CORPORATION 2002-05-30 US disclosed
US-6316637-B1 SELECTIVE FOR CLONED HUMAN ALPHA 2 RECEPTORS AND ARE USEFUL AS ANALGESIC, SEDATIVE OR ANAESTHETIC AGENTS SYNAPTIC PHARMACEUTICAL CORPORATION 2001-11-13 US disclosed
EP-0775134-A4 NOVEL BENZIMIDAZOLE DERIVATIVES SYNAPTIC PHARMA CORP (US) 1997-08-13 EP disclosed
EP-0775134-A1 Imidazolin-2-ylaminobenzimidazole derivatives SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1997-05-28 EP disclosed
WO-1996004270-A1 NOVEL BENZIMIDAZOLE DERIVATIVES SYNAPTIC PHARMACEUTICAL CORPORATION (US) 1996-02-15 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 (4 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-20020065307-A1 Novel benzimidazole derivatives OPRD1, OPRL1, OPRM1 ELANE 4848/4885PRKCI 2441/4885PARP1 1981/4885
US-20020072536-A1 Novel benzimidazole derivatives OPRD1, OPRL1, OPRM1 ELANE 4856/4885PRKCI 2310/4885PARP1 1993/4885
US-20030022927-A1 Novel benzimidazole derivatives OPRL1, OPRD1, OPRM1 ELANE 4830/4885PRKCI 2446/4885PARP1 1981/4885
US-20030181730-A1 Novel benzimidazole derivatives OPRD1, OPRL1, OPRM1 ELANE 4848/4885PRKCI 2441/4885PARP1 1981/4885

“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.