SCHEMBL7309424

SCHEMBL7309424

COc1cccc(C(=O)C2CC2)c1

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.65
CES1 P23141 1/20 0.65
PARP1 P09874 1/20 0.61
NPC1 O15118 4/20 0.60
RAB9A P51151 4/20 0.60
HSD11B1 P28845 1/20 0.59
MGLL Q99685 1/20 0.59
KDM2B Q8NHM5 3/20 0.58
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
PRSS3 P35030 1/20 0.51
ABCG2 Q9UNQ0 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ESR1 P03372 1/20 0.51
ESR2 Q92731 1/20 0.51

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
SCHEMBL31636008 1.00 CES2 (0.65) CES2CES1PARP1NPC1RAB9A
SCHEMBL18360283 0.93 KDM2B (0.62) CES2CES1PARP1NPC1RAB9A
SCHEMBL6208933 0.90 CES2 (0.57) CES2CES1PARP1NPC1RAB9A
Hydrochloric Acid SCHEMBL16432038 0.89 HTR2C (0.57) CES2CES1PARP1NPC1RAB9A
SCHEMBL5210032 0.88 MGLL (0.62) CES2CES1PARP1HSD11B1MGLL
SCHEMBL30771226 0.88 MGLL (0.62) CES2CES1PARP1HSD11B1MGLL
SCHEMBL2992325 0.88 CES2 (0.54) CES2CES1PARP1NPC1RAB9A
SCHEMBL20934473 0.88 CES2 (0.54) CES2CES1PARP1NPC1RAB9A
SCHEMBL20934574 0.88 CES2 (0.54) CES2CES1PARP1NPC1RAB9A
SCHEMBL2992324 0.88 CES2 (0.54) CES2CES1PARP1NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025137310-A1 CRYSTALLINE GPR40 AGONIST AND METHODS OF MAKING KALLYOPE, INC. (US) 2025-06-26 WO disclosed
CN-119118807-A Method for synthesizing aryl butanone by ligand-regulated nickel-catalyzed aryl cyclopropyl ketone ring-opening hydrogenation 陕西师范大学 2024-12-13 CN disclosed
EP-3061756-B1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL CO (JP) 2018-11-14 EP disclosed
US-9635857-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-02 US disclosed
US-9635857-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-02 US disclosed
US-9635857-B2 Tetrazolinone compound and use thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2017-05-02 US disclosed
EP-3061756-A1 TETRAZOLINONE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2016-08-31 EP disclosed
EP-3061756-A1 TETRAZOLINONE COMPOUND AND USE THEREOF Sumitomo Chemical Company, Limited (JP) 2016-08-31 EP disclosed
US-20160235065-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-18 US disclosed
US-20160235065-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-18 US disclosed
US-20160235065-A1 TETRAZOLINONE COMPOUND AND USE THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-08-18 US disclosed
WO-2015060461-A1 TETRAZOLINONE COMPOUND AND USE THEREOF 住友化学株式会社 2015-04-30 WO disclosed
US-4596872-A Imidazo[1,2-a]pyridines, and process for their preparation SCHERING A.G. (DE) 1986-06-24 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-20160235065-A1 TETRAZOLINONE COMPOUND AND USE THEREOF MRPS17, TAOK1, TAOK3 CES2 2030/4885CES1 2104/4885PARP1 3223/4885

“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.