SCHEMBL11043316

SCHEMBL11043316

CCOc1ccc(F)cc1C=O

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.54
MAPT P10636 1/20 0.54
LMNA P02545 1/20 0.50
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C19 P33261 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
HPGD P15428 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44

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
SCHEMBL18003639 0.87 ALDH1A1 (0.67) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL18181889 0.86 ALDH1A1 (0.51) ALDH1A1MAPTTDP1L3MBTL1HPGD
SCHEMBL1881661 0.86 LMNA (0.50) ALDH1A1MAPTLMNACYP1A2CYP2D6
SCHEMBL16149742 0.85 ALDH1A1 (0.50) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL18570379 0.84 CACNA1C (0.50) ALDH1A1MAPTLMNAMEN1KMT2A
SCHEMBL117197 0.83 ALDH1A1 (0.46) ALDH1A1MAPTHPGDHTTSMN1; SMN2
SCHEMBL8686048 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL21816457 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL31254214 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AHPGD
SCHEMBL29750759 0.83 ALDH1A1 (0.55) ALDH1A1MAPTMEN1KMT2AHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024105007-A1 AUTOPHAGY INDUCING COMPOUNDS AND USES THEREOF Samsara Therapeutics Inc. (US) 2024-05-23 WO disclosed
US-20220340893-A1 BI-FUNCTIONAL COMPLEXES AND METHODS FOR MAKING AND USING SUCH COMPLEXES NUEVOLUTION A/S (DK) 2022-10-27 US disclosed
CN-110431144-B Cyano-substituted heteroaryl pyrimidone derivatives, and preparation method and application thereof 浙江海正药业股份有限公司 2022-08-05 CN disclosed
US-11142531-B2 Cyano substituted heteroarylpyrimidinone derivative, preparation method and use thereof ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2021-10-12 US disclosed
US-20200102322-A1 CYANO SUBSTITUTED HETEROARYLPYRIMIDINONE DERIVATIVE, PREPARATION METHOD AND USE THEREOF ZHEJIANG HISUN PHARMACEUTICAL CO., LTD. (CN) 2020-04-02 US disclosed
US-4448971-A Hypoglycemic 5-phenyl-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1984-05-15 US disclosed
US-4407811-A Hypoglycemic 5-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1983-10-04 US disclosed
US-4399296-A TRIMETHYLSILYL CYANOHYDRIN INTERMEDIATES PFIZER INC. (US) 1983-08-16 US disclosed
US-4367234-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1983-01-04 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 (2 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-20200102322-A1 CYANO SUBSTITUTED HETEROARYLPYRIMIDINONE DERIVATIVE, PREPARATION METHOD AND USE THEREOF ACACA, COASY, ACACB ALDH1A1 161/4885MAPT 2715/4885LMNA 2283/4885
US-11142531-B2 Cyano substituted heteroarylpyrimidinone derivative, preparation method and use thereof ACACA, COASY, ACACB ALDH1A1 161/4885MAPT 2715/4885LMNA 2283/4885

“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.