SCHEMBL4149135

SCHEMBL4149135

COc1ccc(-c2ccc3c(c2)CCC(N2CCC(c4ccccc4)C2)C3)cn1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 3/20 0.48
TRPV6 Q9H1D0 1/20 0.43
SCD O00767 2/20 0.40
SCD5 Q86SK9 1/20 0.40
CHRNA7 P36544 1/20 0.39
CYP1A2 P05177 2/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2B6 P20813 1/20 0.39
PIK3CD O00329 1/20 0.38
KDR P35968 1/20 0.38
USP30 Q70CQ3 2/20 0.38
SLC18A3 Q16572 1/20 0.38
GPR84 Q9NQS5 1/20 0.36
HSD17B1 P14061 1/20 0.36
HSD17B2 P37059 1/20 0.36
FAAH O00519 2/20 0.35
KCNH2 Q12809 1/20 0.35

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
SCHEMBL4140498 0.82 HRH3 (0.49) SCDCYP1A2CYP11B1CYP11B2CYP3A4
SCHEMBL4136679 0.81 HRH3 (0.51) SCDCYP1A2CYP11B1CYP11B2CYP3A4
SCHEMBL4294921 0.80 USP30 (0.41) SCDSCD5CYP1A2CYP11B1CYP11B2
SCHEMBL4128876 0.80 HRH3 (0.43) SCDCYP1A2CYP11B1CYP11B2CYP3A4
SCHEMBL4144743 0.80 PIK3CA (0.42) SCDCYP1A2CYP11B1CYP11B2CYP3A4
SCHEMBL4139699 0.78 PIK3CA (0.41) SCDCYP1A2CYP11B1CYP11B2CYP3A4
SCHEMBL4136275 0.76 GRIN2B (0.49) GRIN2BFAAH
SCHEMBL4136673 0.75 USP30 (0.40) SCDSCD5CYP1A2CYP11B1CYP11B2
SCHEMBL4776492 0.74 GRIN2B (0.49) GRIN2BUSP30FAAH
SCHEMBL4139671 0.73 USP30 (0.39) SCDSCD5CYP1A2CYP11B1CYP11B2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR MCHARDY STANTON FURST 2009-06-25 US claimed
EP-2007749-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR Pfizer Products Inc. (US) 2008-12-31 EP claimed
WO-2007105053-A2 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR PFIZER PRODUCTS INC. (US) 2007-09-20 WO claimed

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-20090163482-A1 TETRALINES ANTAGONISTS OF THE H-3 RECEPTOR HRH3, HRH4, HRH1 GRIN2B 86/4885TRPV6 683/4885SCD 2645/4885

“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.