SCHEMBL6850932

SCHEMBL6850932

Cc1cccc(OCCCCN(C)C(=O)C2CCc3[nH]cnc3C2)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 1/20 0.41
KMT2A Q03164 4/20 0.39
MEN1 O00255 3/20 0.39
ALDH1A1 P00352 3/20 0.37
PKM P14618 1/20 0.37
TSHR P16473 1/20 0.37
ATM Q13315 1/20 0.37
MAPT P10636 2/20 0.37
MAPK1 P28482 2/20 0.37
FDPS P14324 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
TDP1 Q9NUW8 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HPGD P15428 1/20 0.36
KDM4E B2RXH2 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL6849720 0.80 HTR1B (0.45) KMT2AMEN1ALDH1A1TSHRHPGD
SCHEMBL6851076 0.76 MAPK9 (0.36) KMT2AMEN1ALDH1A1TSHRNPC1
SCHEMBL6851053 0.73 POLB (0.46) KMT2AMEN1PKMTSHRKDM4E
SCHEMBL6846933 0.73 S1PR1 (0.37) KMT2AALDH1A1PKM
SCHEMBL6851354 0.72 SLC6A4 (0.41) NPC1KDM4E
SCHEMBL6849663 0.72 SLC6A4 (0.41) KMT2AMEN1ALDH1A1TDP1HPGD
SCHEMBL6852889 0.71 NLN (0.43) KDM4EADRA1A
SCHEMBL6849691 0.70 HTR3A (0.37) ADRA1A
SCHEMBL3187304 0.69 HTR3A (0.38) KMT2AALDH1A1PKML3MBTL1HPGD
Hydrochloric Acid SCHEMBL9048262 0.68 HTR3A (0.37) KMT2AALDH1A1PKML3MBTL1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6756384-B2 TREATMENT OF DISEASES AND DISORDERS RELATED TO THE HISTAMINE H3 RECEPTOR. NOVO NORDISK A/S (DK) 2004-06-29 US disclosed
US-20030135056-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2003-07-17 US disclosed
EP-1268484-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2003-01-02 EP disclosed
US-6437147-B1 FOR THERAPY OF DISEASES OF CENTRAL NERVOUS SYSTEM, PERIPHERAL NERVOUS SYSTEM, CARDIOVASCULAR SYSTEM, PULMONARY SYSTEM, GASTROINTESTINAL SYSTEM AND ENDOCRINOLOGICAL SYSTEM NOVO NORDISK (DK) 2002-08-20 US disclosed
US-20020058659-A1 Imidazole compounds HIGH POINT PHARMACEUTICALS, LLC 2002-05-16 US disclosed
WO-2001068652-A1 CONDENSED IMIDAZOLES AS HISTAMINE H3 RECEPTOR LIGANDS NOVO NORDISK A/S (DK) 2001-09-20 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 (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-20030135056-A1 Imidazole compounds HRH3, HRH4, HRH2 PPARD 1078/4885KMT2A 300/4885MEN1 1139/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 PPARD 1078/4885KMT2A 300/4885MEN1 1139/4885

“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.