SCHEMBL2773374

SCHEMBL2773374

CCCCOc1cc(C=O)cc(C(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLA2G2A P14555 1/20 0.65
TP53 P04637 1/20 0.53
TSHR P16473 1/20 0.53
PLA2G4B P0C869 8/20 0.51
RARB P10826 4/20 0.49
KMT2A Q03164 1/20 0.48
PLA2G4A P47712 1/20 0.47
NR1H4 Q96RI1 1/20 0.46

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
SCHEMBL3077835 0.85 PLA2G2A (0.80) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL10830829 0.85 PLA2G2A (0.86) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL10068773 0.85 MAPT (0.47) PLA2G2A
SCHEMBL28627609 0.84 PLA2G2A (0.77) PLA2G2ATP53TSHRPLA2G4BRARB
SCHEMBL14986138 0.84 PLA2G2A (0.49) PLA2G2ATP53TSHRPLA2G4BKMT2A
SCHEMBL16247012 0.84 SMN1; SMN2 (0.51) PLA2G2ATSHR
SCHEMBL5883712 0.84 AHR (0.53) PLA2G2ATSHR
SCHEMBL557574 0.82 PLA2G2A (0.54) PLA2G2ATP53TSHRPLA2G4BKMT2A
SCHEMBL11503562 0.81 CNR1 (0.48) PLA2G2AKMT2A
SCHEMBL27893360 0.81 PLA2G2A (0.63) PLA2G2ATP53TSHRPLA2G4BRARB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7846960-B2 FXR agonists ELI LILLY AND COMPANY (US) 2010-12-07 US disclosed
EP-2029547-B1 FXR AGONISTS LILLY CO ELI (US) 2010-04-28 EP disclosed
US-20090270460-A1 FXR AGONISTS JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2009-10-29 US disclosed
EP-2029547-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2009-03-04 EP disclosed
WO-2007140183-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2007-12-06 WO 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-20090270460-A1 FXR AGONISTS NR1H4, SLC10A1, GPBAR1 PLA2G2A 993/4885TP53 4727/4885TSHR 480/4885

“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.