SCHEMBL14825843

SCHEMBL14825843

O=C(O)c1ccnc(CN2CCCN(C(c3ccccc3)c3ccccc3)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ KDM5C P41229 1/20 0.57
▸ KDM4C Q9H3R0 1/20 0.57
▸ ATM Q13315 3/20 0.51
▸ OPRD1 P41143 4/20 0.48
▸ HDAC1 Q13547 2/20 0.47
▸ KCNH2 Q12809 2/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ MEN1 O00255 3/20 0.46
▸ KMT2A Q03164 3/20 0.46
▸ KDM4E B2RXH2 2/20 0.46
▸ ALDH1A1 P00352 2/20 0.46
▸ DRD2 P14416 2/20 0.46
▸ DRD3 P35462 2/20 0.46
▸ MAOB P27338 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ TP53 P04637 1/20 0.44

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
SCHEMBL14825405 0.95 KDM5C (0.62) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825844 0.89 KDM5C (0.55) KDM5CKDM4CATMKCNH2MEN1
SCHEMBL14825425 0.89 ATM (0.58) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825519 0.87 KDM4C (0.53) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825477 0.87 CACNA2D1 (0.55) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825842 0.87 OPRD1 (0.54) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825365 0.85 KDM4C (0.58) KDM5CKDM4CATMOPRD1MEN1
SCHEMBL14825535 0.85 KDM4C (0.53) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL14825493 0.85 KDM4C (0.55) KDM5CKDM4CATMOPRD1HDAC1
SCHEMBL15636461 0.84 KDM4C (0.76) KDM5CKDM4CKDM4EALDH1A1

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-9365553-B2 Heterocyclic compound and H1 receptor antagonist ASKA PHARMACEUTICAL CO., LTD. (JP) 2016-06-14 — — US disclosed
US-9365553-B2 Heterocyclic compound and H1 receptor antagonist ASKA PHARMACEUTICAL CO., LTD. (JP) 2016-06-14 — — US disclosed
EP-2578569-B1 HETEROCYCLIC RING COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARM CO LTD (JP) 2015-10-28 — — EP disclosed
EP-2578569-A1 HETEROCYCLIC RING COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA Pharmaceutical Co., Ltd. (JP) 2013-04-10 — — EP disclosed
US-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARMACEUTICAL CO., LTD (JP) 2013-04-04 — — US disclosed
US-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST ASKA PHARMACEUTICAL CO., LTD (JP) 2013-04-04 — — 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 (1 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-20130085127-A1 HETEROCYCLIC COMPOUND AND H1 RECEPTOR ANTAGONIST HRH2, HRH4, HRH1 KDM5C 2930/4885KDM4C 3070/4885ATM 3898/4885

“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.

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