SCHEMBL17192068

SCHEMBL17192068

CC(C)c1c(O)c(O)cc2cc[n+](C(C)C)cc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BCL2 P10415 2/20 0.41
BCL2L1 Q07817 2/20 0.41
MCL1 Q07820 2/20 0.41
BCL2L2 Q92843 2/20 0.41
ALB P02768 3/20 0.33
AHR P35869 1/20 0.32
LDHA P00338 3/20 0.31
LDHB P07195 3/20 0.31
CDC42 P60953 2/20 0.31
RAC1 P63000 2/20 0.31
RNASEH1 O60930 1/20 0.30
KDM4E B2RXH2 1/20 0.30
MEN1 O00255 1/20 0.30
NPC1 O15118 1/20 0.30
USP2 O75604 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
ESR1 P03372 1/20 0.30
TP53 P04637 1/20 0.30
CYP1A2 P05177 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
SCHEMBL17192066 0.88 BCL2 (0.41) BCL2BCL2L1MCL1BCL2L2ALB
SCHEMBL17192075 0.76 GABRA1 (0.37) BCL2BCL2L1MCL1MEN1USP2
SCHEMBL17191925 0.74 ALOX15 (0.31) KDM4EMEN1USP2ALDH1A1LMNA
SCHEMBL19420687 0.73 PTPN22 (0.42) CDC42RAC1RNASEH1KDM4EMEN1
SCHEMBL17192073 0.73 GABRA1 (0.37) LMNACYP1A2CYP3A4HPGDBLM
SCHEMBL20869600 0.73 CDC42 (0.32) CDC42RAC1
SCHEMBL17192065 0.73 GABRA1 (0.37) LMNACYP1A2CYP3A4HPGDBLM
SCHEMBL19202196 0.73 TRPM4 (0.50) BCL2BCL2L1MCL1BCL2L2AHR
SCHEMBL19420685 0.72 ESR1 (0.31) ESR1
SCHEMBL10714695 0.67 MCL1 (0.49) BCL2BCL2L1MCL1BCL2L2ALB

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
US-10174053-B2 2 substituted cephem compounds GLAXO GROUP LIMITED (GB) 2019-01-08 US disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
US-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS GLAXO GROUP LIMITED (GB) 2017-10-05 US disclosed
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 (3 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-20170281532-A1 2 SUBSTITUTED CEPHEM COMPOUNDS CEP170, CES2, CMBL BCL2 1976/4885BCL2L1 1180/4885MCL1 1591/4885
US-20150299223-A1 2-SUBSTITUTED CEPHEM COMPOUNDS CEP170, ABL1, CEPT1 BCL2 2021/4885BCL2L1 1207/4885MCL1 1079/4885
US-10174053-B2 2 substituted cephem compounds CEP170, CES2, CMBL BCL2 1976/4885BCL2L1 1180/4885MCL1 1591/4885

“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.