SCHEMBL18769019

SCHEMBL18769019

CC(=O)C1CCC1C(C)=O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
BLM P54132 3/20 0.35
CYP2D6 P10635 2/20 0.35
TSHR P16473 2/20 0.35
ALOX15 P16050 2/20 0.35
PMP22 Q01453 2/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
RAB9A P51151 1/20 0.35
MEN1 O00255 1/20 0.35
THRB P10828 1/20 0.35
KMT2A Q03164 1/20 0.35
MAPT P10636 1/20 0.34
ALDH1A1 P00352 2/20 0.33
ATM Q13315 1/20 0.33
GABRR1 P24046 1/20 0.33
THPO P40225 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33

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
SCHEMBL19658368 1.00 LMNA (0.36) LMNABLMCYP2D6TSHRALOX15
SCHEMBL18532477 0.90 EPHX1 (0.39) BLMMEN1KMT2AMAPTALDH1A1
SCHEMBL14066980 0.87 GABRR1 (0.46) LMNABLMCYP2D6TSHRALOX15
SCHEMBL25575135 0.87 GABRR1 (0.46) LMNABLMCYP2D6TSHRALOX15
SCHEMBL19658338 0.86 EPHX1 (0.46) EPHX1KDM4E
SCHEMBL2617042 0.86 EPHX1 (0.46) EPHX1KDM4E
SCHEMBL22872257 0.86 EPHX1 (0.46) EPHX1KDM4E
SCHEMBL18735714 0.86 EPHX1 (0.46) EPHX1KDM4E
SCHEMBL13872421 0.86 EPHX1 (0.40) BLMMEN1KMT2AMAPTALDH1A1
SCHEMBL25574876 0.86 EPHX1 (0.40) BLMMEN1KMT2AMAPTALDH1A1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170355743-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME CORP. (US) 2017-12-14 US disclosed
US-20170107268-A1 INSULIN RECEPTOR PARTIAL AGONISTS MERCK SHARP & DOHME CORP. (US) 2017-04-20 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 (2 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-20170355743-A1 INSULIN RECEPTOR PARTIAL AGONISTS INSR, GPR119, IRS1 LMNA 4484/4885BLM 3850/4885CYP2D6 2972/4885
US-20170107268-A1 INSULIN RECEPTOR PARTIAL AGONISTS INSR, GPR119, IRS1 LMNA 4484/4885BLM 3850/4885CYP2D6 2972/4885

“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.