SCHEMBL17192043

SCHEMBL17192043

COc1ccc(COc2cc3c(c(Cl)c2OCc2ccc(OC)cc2)c(=O)c(C(=O)N2CCN4CCC2NC4)cn3C)cc1

nearest known ligand 0.34

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PREP P48147 1/20 0.34
CHRM1 P11229 6/20 0.32
GRIN2C Q14957 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
APP P05067 1/20 0.31
KDM4E B2RXH2 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
POLB P06746 1/20 0.31
CYP3A4 P08684 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
HPGD P15428 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GFER P55789 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
SCHEMBL17181448 0.89 PREP (0.36) PREPCHRM1GRIN2CKDM4ELMNA
SCHEMBL17181465 0.79 CHRM1 (0.44) CHRM1HRH3KDM4ELMNACYP1A2
SCHEMBL17192038 0.79 KDM4E (0.43) PREPKDM4ELMNACYP1A2POLB
SCHEMBL17181557 0.77 TP53 (0.40) KDM4ELMNACYP1A2POLBCYP3A4
SCHEMBL15680503 0.75 CHRNA7 (0.39) PREPCHRM1SMN1; SMN2
SCHEMBL17181530 0.74 POLB (0.46) HRH3KDM4ELMNACYP1A2POLB
SCHEMBL15991610 0.74 HRH3 (0.45) HRH3KDM4ESMN1; SMN2
SCHEMBL14845160 0.73 PIK3CD (0.42) PREPCHRM1HRH3KDM4ELMNA
SCHEMBL15991707 0.71 TP53 (0.38) PREPKDM4ELMNACYP1A2POLB
SCHEMBL14699773 0.71 UGCG (0.41) CHRM1GRIN2CHRH3KDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LTD (GB) 2015-10-22 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 (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-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 PREP 951/4885CHRM1 2403/4885GRIN2C 2948/4885

“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.