SCHEMBL6849634

SCHEMBL6849634

O=C(Cc1ccc(Cl)cc1)NCC1CCCc2[nH]cnc21

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.43
CDK1 P06493 1/20 0.43
CDK2 P24941 1/20 0.43
MAPK1 P28482 1/20 0.43
GSK3A P49840 1/20 0.43
GSK3B P49841 1/20 0.43
LMNA P02545 4/20 0.43
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
KMT2A Q03164 3/20 0.38
MEN1 O00255 2/20 0.38
ALDH1A1 P00352 1/20 0.38
P2RX7 Q99572 2/20 0.37
ERCC1 P07992 1/20 0.37
ERCC4 Q92889 1/20 0.37
GRM7 Q14831 1/20 0.37
EGFR P00533 1/20 0.36
ERBB2 P04626 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
SCHEMBL6851398 0.89 KMT2A (0.40) CDK1CDK2MAPK1GSK3AGSK3B
SCHEMBL6853121 0.89 SMN1; SMN2 (0.43) POLBCDK1CDK2MAPK1GSK3A
SCHEMBL6849675 0.88 ALDH1A1 (0.41) POLBLMNAKMT2AALDH1A1
SCHEMBL6850903 0.83 NPC1 (0.41) NPC1RAB9AKMT2AMEN1ALDH1A1
SCHEMBL6846960 0.78 HRH3 (0.42) POLBLMNAKMT2AMEN1ALDH1A1
SCHEMBL6849610 0.76 LMNA (0.43) POLBCDK1CDK2MAPK1GSK3A
SCHEMBL6847114 0.76 L3MBTL1 (0.42) LMNANPC1RAB9AKMT2AMEN1
SCHEMBL6850901 0.74 CCNA2 (0.42) CDK1CDK2GSK3ALMNASMN1; SMN2
SCHEMBL7141811 0.73 NPC1 (0.39) SMN1; SMN2NPC1RAB9AKMT2AMEN1
SCHEMBL6957290 0.73 LMNA (0.47) POLBLMNARAB9AALDH1A1KDM4E

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 POLB 4423/4885CDK1 1075/4885CDK2 637/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 POLB 4423/4885CDK1 1075/4885CDK2 637/4885

“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.