SCHEMBL25937607

SCHEMBL25937607

CCOC1(C)OC(=O)c2ccc(F)cc21

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.45
PTGS1 P23219 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
CYP3A4 P08684 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
AKR1B1 P15121 2/20 0.35
AKR1A1 P14550 1/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
MALT1 Q9UDY8 1/20 0.35
MAOB P27338 2/20 0.34
HSD11B1 P28845 1/20 0.34
MAPK1 P28482 1/20 0.34
MEN1 O00255 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL25141597 0.80 SMN1; SMN2 (0.42) PTGS2PTGS1SMN1; SMN2CYP3A4L3MBTL1
SCHEMBL30286665 0.73 AKR1B1 (0.39) AKR1B1AKR1A1MALT1KMT2A
SCHEMBL11840337 0.67 PDK2 (0.43) AKR1B1AKR1A1NPSR1MALT1
SCHEMBL4728535 0.65 CYP11B2 (0.40) L3MBTL1CYP2C9CYP2C19NPSR1MALT1
SCHEMBL9506732 0.65 SMN1; SMN2 (0.62) SMN1; SMN2CYP3A4L3MBTL1CYP2C9CYP2C19
SCHEMBL31217549 0.65 ALDH1A1 (0.45) SMN1; SMN2MALT1MAOB
SCHEMBL4367569 0.64 AVPR1A (0.48) AKR1B1
SCHEMBL29922364 0.64 NPY5R (0.43) AKR1B1AKR1A1MALT1KMT2A
SCHEMBL22057308 0.63 NPY5R (0.45) AKR1B1AKR1A1
SCHEMBL29922140 0.63 MALT1 (0.43) L3MBTL1MALT1MAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11767312-B2 Phthalazinone compound, and preparation method therefor and medical use thereof GENENTECH, INC. (US) 2023-09-26 US disclosed
US-20230242510-A1 PHTHALAZINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF SHANGHAI JEMINCARE PHARMACEUTICALS CO LTD (CN) 2023-08-03 US disclosed
US-20230131252-A1 PHTHALAZINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF SHANGHAI JEYOU PHARMACEUTICAL CO., LTD. (CN) 2023-04-27 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-11767312-B2 Phthalazinone compound, and preparation method therefor and medical use thereof CYP17A1, AR, NR5A1 PTGS2 2008/4885PTGS1 1310/4885SMN1; SMN2 4611/4885
US-20230131252-A1 PHTHALAZINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF CYP17A1, AR, NR5A1 PTGS2 2008/4885PTGS1 1310/4885SMN1; SMN2 4611/4885
US-20230242510-A1 PHTHALAZINONE COMPOUND, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF CYP17A1, AR, NR5A1 PTGS2 2008/4885PTGS1 1310/4885SMN1; SMN2 4611/4885

“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.