SCHEMBL6852996

SCHEMBL6852996

O=C(CCc1ccc(Cl)cc1)NCCC1CCCc2[nH]cnc21

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.43
ATM Q13315 1/20 0.43
LTA4H P09960 1/20 0.38
EPHX2 P34913 1/20 0.38
FLT3 P36888 1/20 0.38
THRB P10828 1/20 0.38
HRH3 Q9Y5N1 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
HSD17B10 Q99714 2/20 0.37
P2RX7 Q99572 1/20 0.37
TSHR P16473 1/20 0.37
EPHX1 P07099 1/20 0.37
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
CASP1 P29466 1/20 0.36
CNR1 P21554 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 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
SCHEMBL6846960 0.94 HRH3 (0.42) KMT2AATMHRH3L3MBTL1HSD17B10
SCHEMBL6851398 0.90 KMT2A (0.40) KMT2AATMLTA4HEPHX2FLT3
SCHEMBL6853121 0.90 SMN1; SMN2 (0.43) KMT2ALTA4HEPHX2ALDH1A1LMNA
SCHEMBL7654772 0.84 ALDH1A1 (0.38) P2RX7TSHRALDH1A1LMNANPC1
SCHEMBL6849675 0.84 ALDH1A1 (0.41) KMT2AATMHRH3L3MBTL1EPHX1
SCHEMBL6847114 0.83 L3MBTL1 (0.42) KMT2AL3MBTL1TSHRALDH1A1LMNA
SCHEMBL6849634 0.79 POLB (0.43) KMT2AP2RX7ALDH1A1LMNANPC1
SCHEMBL7141811 0.78 NPC1 (0.39) KMT2AL3MBTL1P2RX7ALDH1A1NPC1
SCHEMBL6850901 0.77 CCNA2 (0.42) KMT2AALDH1A1LMNA
SCHEMBL6851432 0.71 P2RX7 (0.38) KMT2AATMLTA4HL3MBTL1HSD17B10

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 KMT2A 300/4885ATM 2840/4885LTA4H 415/4885
US-20020058659-A1 Imidazole compounds HRH3, HRH4, HRH2 KMT2A 300/4885ATM 2840/4885LTA4H 415/4885

“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.