SCHEMBL22235337

SCHEMBL22235337

CCC(=O)Cc1ccc(Br)cc1F

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 1/20 0.43
AKR1B1 P15121 6/20 0.43
P2RX7 Q99572 2/20 0.43
PDPK1 O15530 1/20 0.43
PYCR1 P32322 1/20 0.42
MAPT P10636 3/20 0.42
POLB P06746 1/20 0.42
BMP1 P13497 1/20 0.40
MEN1 O00255 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
FPR2 P25090 1/20 0.37

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
SCHEMBL12501525 0.83 DGAT1 (0.43) DGAT1AKR1B1P2RX7PDPK1PYCR1
SCHEMBL23869529 0.82 RIPK1 (0.48) P2RX7MAPT
SCHEMBL8444 0.82 DGAT1 (0.46) DGAT1AKR1B1P2RX7PDPK1PYCR1
SCHEMBL12709967 0.81 CHRNA7 (0.46) MAPTMEN1KMT2A
SCHEMBL22539808 0.81 P2RX7 (0.43) P2RX7MAPTMEN1CYP1A2CYP2C9
SCHEMBL29574729 0.80 AKR1B1 (0.52) DGAT1AKR1B1P2RX7PDPK1MEN1
SCHEMBL5835 0.80 AKR1B1 (0.52) DGAT1AKR1B1P2RX7PDPK1MEN1
SCHEMBL1310479 0.79 PYCR1 (0.50) DGAT1AKR1B1P2RX7PDPK1PYCR1
SCHEMBL12069886 0.79 MAPT (0.44) DGAT1AKR1B1P2RX7PDPK1MAPT
SCHEMBL31342163 0.79 MAPT (0.44) DGAT1AKR1B1P2RX7PDPK1MAPT

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-20230072397-A1 Antimicrobial Compounds and Methods NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2023-03-09 US disclosed
CN-113825748-A Antimicrobial compounds and methods 库扎环球有限责任公司 2021-12-21 CN disclosed
EP-3911643-A1 ANTIMICROBIAL COMPOUNDS AND METHODS Curza Global LLC (US) 2021-11-24 EP disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 WO disclosed
WO-2020150372-A1 ANTIMICROBIAL COMPOUNDS AND METHODS CURZA GLOBAL, LLC (US) 2020-07-23 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-20230072397-A1 Antimicrobial Compounds and Methods MPO, NISCH, RPN2 DGAT1 598/4885AKR1B1 4260/4885P2RX7 2281/4885

“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.