SCHEMBL6750447

SCHEMBL6750447

CCOC(=O)c1ccc(NC(=O)c2ccc3c(c2)Nc2nccnc2S3)cc1

nearest known ligand 0.62

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 1/20 0.62
L3MBTL1 Q9Y468 2/20 0.51
KDM4E B2RXH2 2/20 0.51
ALOX15 P16050 1/20 0.51
SMN1; SMN2 Q16637 6/20 0.50
RAB9A P51151 6/20 0.50
NPC1 O15118 4/20 0.50
MAPT P10636 6/20 0.49
TSHR P16473 1/20 0.49
GAA P10253 3/20 0.48
ALDH1A1 P00352 2/20 0.48
MAPK1 P28482 1/20 0.48
TP53 P04637 3/20 0.47
KMT2A Q03164 3/20 0.45
NAMPT P43490 1/20 0.45
ICAM1 P05362 1/20 0.44
MEN1 O00255 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
SCHEMBL6745505 0.82 ICAM1 (0.46) RXFP1KDM4ESMN1; SMN2MAPTGAA
SCHEMBL6747412 0.80 GAA (0.47) KDM4EALOX15SMN1; SMN2MAPTGAA
SCHEMBL6747446 0.77 KDM4E (0.51) KDM4ESMN1; SMN2MAPTGAAICAM1
SCHEMBL6749079 0.73 ICAM1 (0.56) KDM4ESMN1; SMN2MAPTGAAICAM1
SCHEMBL22441225 0.73 RAB9A (0.63) L3MBTL1KDM4EALOX15SMN1; SMN2RAB9A
SCHEMBL5879030 0.71 RAB9A (0.88) L3MBTL1KDM4EALOX15SMN1; SMN2RAB9A
SCHEMBL10943445 0.71 RAB9A (0.88) L3MBTL1KDM4EALOX15SMN1; SMN2RAB9A
SCHEMBL31680576 0.71 RAB9A (0.81) L3MBTL1SMN1; SMN2RAB9ANPC1MAPT
SCHEMBL3571275 0.70 RAB9A (0.57) RXFP1L3MBTL1KDM4EALOX15SMN1; SMN2
SCHEMBL9147559 0.70 RXFP1 (0.56) RXFP1L3MBTL1KDM4ESMN1; SMN2RAB9A

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 RXFP1 567/4885L3MBTL1 4411/4885KDM4E 1573/4885

“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.