SCHEMBL5520040

SCHEMBL5520040

CCOC(=O)/C=C(/C)c1ccc(-c2ccc(F)cc2)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.44
KMT2A Q03164 3/20 0.44
MEN1 O00255 2/20 0.44
CASP3 P42574 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
CYP1A2 P05177 2/20 0.44
LMNA P02545 2/20 0.44
NPSR1 Q6W5P4 2/20 0.44
CYP2C9 P11712 1/20 0.44
CYP2C19 P33261 1/20 0.44
BCL2L1 Q07817 1/20 0.43
BAD Q92934 1/20 0.43
SMN1; SMN2 Q16637 2/20 0.42
KDM4E B2RXH2 5/20 0.41
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
TRPM8 Q7Z2W7 1/20 0.40
GRM6 O15303 1/20 0.40

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
SCHEMBL5520042 1.00 MAPT (0.44) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL14615017 1.00 MAPT (0.44) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL7345446 0.95 MAPT (0.48) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL7345443 0.95 MAPT (0.48) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL26364967 0.95 MAPT (0.48) MAPTKMT2AMEN1CASP3TRPV1
SCHEMBL6484891 0.86 SMN1; SMN2 (0.49) MAPTKMT2AMEN1CASP3SENP7
SCHEMBL5525560 0.86 SMN1; SMN2 (0.49) MAPTKMT2AMEN1CASP3SENP7
SCHEMBL5525558 0.86 SMN1; SMN2 (0.49) MAPTKMT2AMEN1CASP3SENP7
SCHEMBL11541038 0.85 PTGS2 (0.42) MAPTKMT2AMEN1LMNAKDM4E
SCHEMBL11541042 0.85 PTGS2 (0.42) MAPTKMT2AMEN1LMNAKDM4E

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-20070043035-A1 Novel compounds and their use in medicine: process for their preparation and pharmaceutical compositions containing them DR. REDDY'S LABORATORIES LIMITED (IN) 2007-02-22 US disclosed
EP-1678128-A1 NOVEL COMPOUNDS AND THEIR USE IN MEDICINE: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM Dr. Reddy's Laboratories Ltd. (IN) 2006-07-12 EP disclosed
WO-2005040104-A1 NOVEL COMPOUNDS AND THEIR USE IN MEDICINE: PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DR. REDDY'S LABORATORIES LTD. (IN) 2005-05-06 WO disclosed
US-3980795-A Pyrazolidinones and a process for their preparation MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DT) 1976-09-14 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-20070043035-A1 Novel compounds and their use in medicine: process for their preparation and pharmaceutical compositions containing them GPR119, LIPA, LIPC MAPT 4179/4885KMT2A 3433/4885MEN1 2167/4885

“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.