SCHEMBL6749797

SCHEMBL6749797

C=COCC=C1CCN(Cc2ccccc2)CC1

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.49
HRH3 Q9Y5N1 1/20 0.45
MC4R P32245 1/20 0.42
DRD4 P21917 1/20 0.41
LMNA P02545 1/20 0.41
POLB P06746 1/20 0.41
ACHE P22303 1/20 0.41
CYP3A4 P08684 1/20 0.40
HSD17B10 Q99714 1/20 0.40
CCR3 P51677 1/20 0.40
MEN1 O00255 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
KMT2A Q03164 1/20 0.39
GAA P10253 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
SCHEMBL27323536 0.78 SIGMAR1 (0.59) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL8380136 0.76 SIGMAR1 (0.57) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL2452523 0.76 SIGMAR1 (0.57) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL7499611 0.75 SIGMAR1 (0.55) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL9690053 0.74 MEN1 (0.48) SIGMAR1LMNAACHECYP3A4MEN1
SCHEMBL4506489 0.74 SIGMAR1 (0.53) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL5763310 0.73 CCR3 (0.55) SIGMAR1HRH3MC4RCCR3KMT2A
SCHEMBL11884735 0.73 SIGMAR1 (0.52) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL4772258 0.73 SIGMAR1 (0.61) SIGMAR1HRH3MC4RDRD4LMNA
SCHEMBL7380692 0.72 SIGMAR1 (0.55) SIGMAR1HRH3MC4RDRD4LMNA

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-20040092737-A1 Benzopiperidine derivatives EISAI CO., LTD. 2004-05-13 US disclosed
US-6518423-B1 These compounds are useful as drugs efficacious in the prevention and treatment of these various inflammatory diseases and immunologic diseases, such as rheumatoid arthritis, atopic dermatitis, psoriasis, asthma, and EISAI CO., LTD. (JP) 2003-02-11 US disclosed
EP-0934941-A1 BENZOPIPERIDINE DERIVATIVES Eisai Co., Ltd. (JP) 1999-08-11 EP 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-20040092737-A1 Benzopiperidine derivatives HLA-DRB1, HRH1, HRH2 SIGMAR1 1579/4885HRH3 12/4885MC4R 1614/4885

“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.