SCHEMBL5794028

SCHEMBL5794028

CN(Cc1ccc2[nH]c(CN3CCCC3)cc2c1)Cc1nnc(-c2ccccc2)o1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.49
RAB9A P51151 2/20 0.49
ATM Q13315 1/20 0.49
ALDH1A1 P00352 2/20 0.44
KCNH2 Q12809 2/20 0.44
POLB P06746 1/20 0.44
HRH4 Q9H3N8 1/20 0.43
HRH3 Q9Y5N1 1/20 0.42
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 3/20 0.40
CHEK1 O14757 2/20 0.40
CDK7 P50613 1/20 0.40
GAA P10253 2/20 0.39
DRD2 P14416 1/20 0.39
DRD4 P21917 1/20 0.39
DRD3 P35462 1/20 0.39
HPGD P15428 2/20 0.38
TSHR P16473 2/20 0.38
KDM4E B2RXH2 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
SCHEMBL5794526 0.84 NPC1 (0.53) KMT2ARAB9AALDH1A1KCNH2POLB
SCHEMBL5793164 0.78 HRH4 (0.43) RAB9AALDH1A1POLBHRH4HRH3
SCHEMBL5794049 0.75 HRH4 (0.45) HRH4HRH3CHEK1CDK7DRD2
SCHEMBL5796265 0.74 HRH4 (0.46) KMT2AALDH1A1HRH4HRH3MEN1
SCHEMBL5793661 0.74 HRH4 (0.43) HRH4HRH3CHEK1CDK7DRD2
SCHEMBL5793366 0.73 HRH4 (0.42) HRH4HRH3CHEK1CDK7DRD2
SCHEMBL5797148 0.72 HRH4 (0.41) HRH4HRH3CHEK1CDK7DRD2
SCHEMBL5793998 0.71 HRH4 (0.42) KMT2AALDH1A1HRH4HRH3MAPT
SCHEMBL5917657 0.71 HRH4 (0.42) HRH4HRH3CHEK1CDK7DRD2
SCHEMBL5793372 0.71 HRH4 (0.42) HRH4HRH3MAPTCHEK1CDK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006035308-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-04-06 WO claimed
US-20060069087-A1 Histamine-3 receptor antagonists PFIZER INC 2006-03-30 US claimed
WO-2006035308-A1 HISTAMINE-3 RECEPTOR ANTAGONISTS PFIZER PRODUCTS INC. (US) 2006-04-06 WO disclosed
US-20060069087-A1 Histamine-3 receptor antagonists PFIZER INC 2006-03-30 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-20060069087-A1 Histamine-3 receptor antagonists HRH3, HRH4, HRH2 KMT2A 1130/4885RAB9A 291/4885ATM 1401/4885

“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.