SCHEMBL1950287

SCHEMBL1950287

CC(C)(C(N)=O)N1CCc2c[c]ccc2CC1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
NR1H2 P55055 1/20 0.32
NOTUM Q6P988 1/20 0.31
RIPK1 Q13546 1/20 0.31
HDAC6 Q9UBN7 1/20 0.30

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
SCHEMBL2510116 0.74 NR1H2 (0.53) LMNASMN1; SMN2NR1H2HDAC6
SCHEMBL217306 0.73 DRD2 (0.48)
SCHEMBL7469070 0.71 ESR1 (0.51) NOTUMHDAC6
SCHEMBL5727021 0.70 HTR1A (0.35)
SCHEMBL22502088 0.69 LMNA (0.36) LMNASMN1; SMN2
SCHEMBL6962545 0.69 MEN1 (0.41) LMNARIPK1HDAC6
SCHEMBL8013063 0.69 NOTUM (0.63) LMNASMN1; SMN2NOTUM
SCHEMBL3486703 0.69 NOTUM (0.63) LMNASMN1; SMN2NOTUM
SCHEMBL952312 0.69 ESR2 (0.62) LMNASMN1; SMN2NR1H2
SCHEMBL697852 0.69 KMT2A (0.41) SMN1; SMN2NOTUMHDAC6

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
EP-2168966-B1 BICYCLOANILINE DERIVATIVE MSD KK (JP) 2016-09-28 EP disclosed
US-8436004-B2 Bicycloaniline derivative MSD K.K. (JP) 2013-05-07 US disclosed
US-20110135601-A1 BICYCLOANILINE DERIVATIVE BANYU PHARMACEUTICAL CO., LTD. 2011-06-09 US disclosed
EP-2168966-A1 BICYCLOANILINE DERIVATIVE Banyu Pharmaceutical Co., Ltd. (JP) 2010-03-31 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-20110135601-A1 BICYCLOANILINE DERIVATIVE WEE1, WEE2, CCNK LMNA 2057/4885SMN1; SMN2 4185/4885NR1H2 1731/4885

“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.