SCHEMBL6307461

SCHEMBL6307461

COc1ccc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CCN(C4)C3)cc2)cn1

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 0.56
GPR183 P32249 1/20 0.43
HPGDS O60760 2/20 0.43
PAK1 Q13153 1/20 0.42
NAAA Q02083 1/20 0.42
USP30 Q70CQ3 2/20 0.41
BTK Q06187 1/20 0.41
FAAH O00519 1/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
MMP2 P08253 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39

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
SCHEMBL6307465 1.00 CHRNA7 (0.56) CHRNA7GPR183HPGDSPAK1NAAA
SCHEMBL6311008 0.95 CHRNA7 (0.49) CHRNA7GPR183HPGDSPAK1NAAA
SCHEMBL6305790 0.88 CHRNA7 (0.58) CHRNA7PAK1NAAAUSP30KMT2A
SCHEMBL6305794 0.88 CHRNA7 (0.58) CHRNA7PAK1NAAAUSP30KMT2A
SCHEMBL6303017 0.87 CHRNA7 (0.66) CHRNA7NAAAUSP30MEN1KMT2A
SCHEMBL6303021 0.87 CHRNA7 (0.66) CHRNA7NAAAUSP30MEN1KMT2A
SCHEMBL6303155 0.87 CHRNA7 (0.66) CHRNA7NAAAUSP30MMP2MMP13
SCHEMBL6303153 0.87 CHRNA7 (0.66) CHRNA7NAAAUSP30MMP2MMP13
SCHEMBL6311955 0.84 CHRNA7 (0.69) CHRNA7HPGDSMEN1KMT2A
SCHEMBL6311947 0.84 CHRNA7 (0.69) CHRNA7HPGDSMEN1KMT2A

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
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US claimed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
US-6852716-B2 Substituted-aryl compounds for treatment of disease PFIZER INC (US) 2005-02-08 US disclosed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 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-20030236279-A1 Substituted-aryl compounds for treatment of disease NAT1, CYP7A1, CYP7B1 CHRNA7 2937/4885GPR183 1237/4885HPGDS 885/4885

“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.