SCHEMBL19087045

SCHEMBL19087045

Cc1cnn(Cc2ccccc2C(=O)O)c1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.44
MAPT P10636 1/20 0.44
KLKB1 P03952 2/20 0.43
GAA P10253 1/20 0.43
KDM4E B2RXH2 1/20 0.42
BRD4 O60885 2/20 0.42
FOLH1 Q04609 1/20 0.41
KDR P35968 1/20 0.41
DHODH Q02127 1/20 0.41
ALPI P09923 1/20 0.41
ALPG P10696 1/20 0.41
PLAA Q9Y263 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
MYC P01106 2/20 0.41
NR4A1 P22736 1/20 0.41
POLB P06746 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 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
SCHEMBL19087043 0.85 ALDH1A1 (0.53) ALDH1A1MAPTKLKB1KDM4EKDR
SCHEMBL19077853 0.83 ALDH1A1 (0.41) ALDH1A1MAPTKDM4EBRD4FOLH1
SCHEMBL27286147 0.83 L3MBTL1 (0.43) ALDH1A1MAPTKLKB1KDM4EBRD4
SCHEMBL19116685 0.83 NR4A3 (0.43) ALDH1A1MAPTKDM4EBRD4FOLH1
SCHEMBL27395876 0.82 ALDH1A1 (0.40) ALDH1A1MAPTKDM4EBRD4FOLH1
SCHEMBL19158354 0.78 ALDH1A1 (0.49) ALDH1A1MAPTKDM4ESMN1; SMN2POLB
SCHEMBL27721656 0.78 LMNA (0.45) KLKB1ALPIALPGPLAALMNA
SCHEMBL29391153 0.77 KDR (0.41) ALDH1A1KLKB1KDRTDP1
SCHEMBL6937025 0.75 HPGD (0.46) ALDH1A1MAPTKLKB1GAASMN1; SMN2
SCHEMBL17786883 0.75 ALDH1A1 (0.43) ALDH1A1MAPTKLKB1GAAKDM4E

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
WO-2024026483-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
WO-2024026481-A2 CDK2 INHIBITORS AND METHODS OF USING THE SAME CEDILLA THERAPEUTICS, INC. (US) 2024-02-01 WO disclosed
EP-3792256-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS Incyte Corporation (US) 2021-03-17 EP disclosed
EP-3400221-B1 PYRAZOL / IMIDAZOL SUBSTITUTED PYRIDINES AS PI3K-GAMMA INHIBITORS INCYTE CORP (US) 2020-08-26 EP disclosed
US-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS INCYTE CORPORATION 2017-07-06 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-20170190689-A1 PYRIDINE AND PYRIDIMINE COMPOUNDS AS PI3K-GAMMA INHIBITORS PIK3CG, PIK3CD, PIK3CB ALDH1A1 2997/4885MAPT 3007/4885KLKB1 3723/4885

“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.