SCHEMBL3428038

SCHEMBL3428038

Cc1cc(C=O)ccc1OCCCC1CCN(C)CC1

nearest known ligand 0.51

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 6/20 0.51
FDPS P14324 1/20 0.42
CYP1A2 P05177 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C19 P33261 1/20 0.41
KDM4E B2RXH2 4/20 0.40
RECQL P46063 1/20 0.40
QPCT Q16769 1/20 0.39
ALDH1A1 P00352 2/20 0.39
ALDH1A3 P47895 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
HRH4 Q9H3N8 1/20 0.38

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
SCHEMBL3424699 0.81 ALDH1A1 (0.52) FDPSCYP1A2CYP3A4CYP2D6CYP2C19
SCHEMBL1626212 0.81 HPGD (0.49) HPGDALDH1A1SMN1; SMN2
SCHEMBL1625904 0.80 KDM4E (0.41) KDM4EQPCTALDH1A1HRH4
SCHEMBL1628159 0.76 MAOB (0.43) KDM4EALDH1A1SMN1; SMN2
SCHEMBL1627975 0.75 HRH4 (0.43) QPCTHRH4
SCHEMBL5451545 0.74 HPGD (0.54) HPGDFDPSALDH1A1ALDH1A3
SCHEMBL5440983 0.74 FDPS (0.54) HPGDFDPSKDM4EALDH1A1SMN1; SMN2
SCHEMBL5692621 0.73 POLB (0.56) KDM4EALDH1A1SMN1; SMN2
SCHEMBL5451218 0.73 HPGD (0.59) HPGDFDPSALDH1A1ALDH1A3
SCHEMBL5449465 0.73 FDPS (0.53) HPGDFDPSALDH1A1SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7723526-B2 Benzoimidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2010-05-25 US disclosed
US-7723527-B2 Benzoimidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2010-05-25 US disclosed
US-7723359-B2 Benzoimidazole compounds JANSSEN PHARMACEUTICA NV (BE) 2010-05-25 US disclosed
US-7705149-B2 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2010-04-27 US disclosed
US-7705143-B2 5-Fluoro-4-methyl-2-{2-[4-(4-methyl-[1,4]diazepan-1-yl)-butoxy]-pyridin-4-yl}-1H-benzoimidazole; use in leukocyte recruitment inhibition, in modulating H4 receptor, and in treating conditions such as inflammation, H4 receptor-mediated conditions JANSSEN PHARMACEUTICA N.V. (BG) 2010-04-27 US disclosed
US-7662966-B2 For example, 5-tert-Butyl-2-{2-[4-(1-methyl-piperidin-4-yl)-butoxy]-pyridin-4-yl}-1H-benzoimidazole; use in leukocyte recruitment inhibition, in modulating H4 receptor, and in treating conditions such as inflammation, H4 receptor-mediated conditions, and related conditions JANSSEN PHARMACEUTICA N.V. (BE) 2010-02-16 US disclosed
US-20090281307-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-12 US disclosed
US-20090275748-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-11-05 US disclosed
US-20090270611-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-29 US disclosed
US-20090270613-A1 Benzoimidazole compounds EDWARDS JAMES P 2009-10-29 US disclosed
US-20090270366-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-29 US disclosed
US-20090264645-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-22 US disclosed
US-20090264646-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-22 US disclosed
US-20090264647-A1 5-Fluoro-4-methyl-2-{2-[4-(4-methyl-piperazin-1-yl)-butoxy]-pyridin-4-yl}-1H-benzoimidazole; leukocyte recruitment inhibition, modulating H4 receptor, and treating conditions such as inflammation JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-22 US disclosed
US-20090247508-A1 Benzoimidazole Compounds JANSSEN PHARMACEUTICA N.V. (BE) 2009-10-01 US disclosed
EP-1673348-B1 BENZOIMIDAZOLE COMPOUNDS JANSSEN PHARMACEUTICA NV (BE) 2009-04-01 EP disclosed
US-7432378-B2 Benzoimidazole compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2008-10-07 US disclosed
EP-1673348-A2 BENZOIMIDAZOLE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2006-06-28 EP disclosed
WO-2005044807-A2 BENZOIMIDAZOLE COMPOUNDS JANSSEN PHARMACEUTICA N.V. (BE) 2005-05-19 WO disclosed
US-20050070550-A1 Benzoimidazole compounds JANSSEN PHARMACEUTICA, N.V. (BE) 2005-03-31 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 (10 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-20090270613-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090264646-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20050070550-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090270366-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090270611-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090275748-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090264647-A1 5-Fluoro-4-methyl-2-{2-[4-(4-methyl-piperazin-1-yl)-butoxy]-pyridin-4-yl}-1H-benzoimidazole; leukocyte recruitment inhibition, modulating H4 receptor, and treating conditions such as inflammation HRH4, HRH3, BRD4 HPGD 1686/4885FDPS 3118/4885CYP1A2 3438/4885
US-20090247508-A1 Benzoimidazole Compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090264645-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885
US-20090281307-A1 Benzoimidazole compounds HRH4, HRH3, BRD4 HPGD 2022/4885FDPS 4018/4885CYP1A2 3797/4885

“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.