SCHEMBL6306569

SCHEMBL6306569

NC(=O)c1ccc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CCN(C4)C3)cc2)cc1

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 7/20 0.67
F2 P00734 6/20 0.49
ST14 Q9Y5Y6 6/20 0.49
USP30 Q70CQ3 2/20 0.48
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
PARP15 Q460N3 1/20 0.46
PARP14 Q460N5 1/20 0.46
PARP10 Q53GL7 1/20 0.46
PARP16 Q8N5Y8 1/20 0.46
PARP11 Q9NR21 1/20 0.46
PARP4 Q9UKK3 1/20 0.46
PRSS1 P07477 3/20 0.45
PRSS2 P07478 3/20 0.45
PRSS3 P35030 3/20 0.45
PLG P00747 2/20 0.45
MMP13 P45452 2/20 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
SCHEMBL6306576 1.00 CHRNA7 (0.67) CHRNA7F2ST14USP30ALDH1A1
SCHEMBL6305118 0.95 CHRNA7 (0.60) CHRNA7F2ST14USP30ALDH1A1
SCHEMBL6303248 0.92 CHRNA7 (0.66) CHRNA7F2ST14USP30PARP10
SCHEMBL6303242 0.92 CHRNA7 (0.66) CHRNA7F2ST14USP30PARP10
SCHEMBL6303119 0.90 CHRNA7 (0.67) CHRNA7USP30MMP13
SCHEMBL6310721 0.90 CHRNA7 (0.67) CHRNA7USP30PARP10MMP13
SCHEMBL6303120 0.90 CHRNA7 (0.67) CHRNA7USP30MMP13
SCHEMBL6310731 0.90 CHRNA7 (0.67) CHRNA7USP30PARP10MMP13
SCHEMBL6309530 0.90 CHRNA7 (0.58) CHRNA7F2ST14USP30PARP15
SCHEMBL6309537 0.90 CHRNA7 (0.58) CHRNA7F2ST14USP30PARP15

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 9 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
EP-1480977-A2 SUBSTITUTED ARYL COMPOUNDS FOR TREATMENT OF DISEASE PHARMACIA & UPJOHN COMPANY (US) 2004-12-01 EP claimed
US-20030236279-A1 Substituted-aryl compounds for treatment of disease PHARMACIA & UPJOHN COMPANY 2003-12-25 US claimed
WO-2003070728-A2 AZABICYCLO-SUBSTITUTED BENZOYLAMIDES AND THIOAMIDES FOR TREATMENT OF CNS-RELATED DISORDERS PHARMACIA & UPJOHN COMPANY (US) 2003-08-28 WO claimed
US-20030162787-A1 Inhibitors of factor Xa and other serine proteases involved in the coagulation cascade WARNER-LAMBERT COMPANY LLC 2003-08-28 US claimed
US-20050250815-A1 Inhibitors of fractor Xa and other serine proteases involved in the coagulation cascade WARNER-LAMBERT COMPANY LLC 2005-11-10 US disclosed
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
US-20030162787-A1 Inhibitors of factor Xa and other serine proteases involved in the coagulation cascade WARNER-LAMBERT COMPANY LLC 2003-08-28 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 (3 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-20030162787-A1 Inhibitors of factor Xa and other serine proteases involved in the coagulation cascade TFPI, F11, F12 CHRNA7 4583/4885F2 5/4885ST14 1407/4885
US-20050250815-A1 Inhibitors of fractor Xa and other serine proteases involved in the coagulation cascade F12, TFPI, F11 CHRNA7 4672/4885F2 4/4885ST14 1597/4885
US-20030236279-A1 Substituted-aryl compounds for treatment of disease NAT1, CYP7A1, CYP7B1 CHRNA7 2937/4885F2 3289/4885ST14 2548/4885

“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.