SCHEMBL19966271

SCHEMBL19966271

O=C(CN1CC(O)C1)OCc1ccccc1

nearest known ligand 0.54

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 5/20 0.53
▸ MAPK1 P28482 1/20 0.53
▸ L3MBTL1 Q9Y468 1/20 0.53
▸ CYP2C19 P33261 2/20 0.48
▸ CYP1A2 P05177 1/20 0.48
▸ CYP2C9 P11712 1/20 0.48
▸ SMN1; SMN2 Q16637 3/20 0.47
▸ KMT2A Q03164 3/20 0.45
▸ SLC6A2 P23975 1/20 0.45
▸ SLC6A3 Q01959 1/20 0.45
▸ TDP1 Q9NUW8 1/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ GLA P06280 1/20 0.44
▸ POLB P06746 1/20 0.44
▸ HTR2C P28335 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.42
▸ NOTUM Q6P988 1/20 0.42

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
SCHEMBL21100933 0.88 LTA4H (0.48) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL19934909 0.88 FUCA1 (0.55) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL23054258 0.86 S1PR5 (0.57) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL10859364 0.85 ALDH1A1 (0.61) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL19604406 0.85 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL24970558 0.85 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL16228724 0.85 NPC1 (0.53) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL21397345 0.84 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL23734315 0.84 ALDH1A1 (0.50) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2
SCHEMBL21440361 0.84 ALDH1A1 (0.49) ALDH1A1MAPK1L3MBTL1CYP2C19CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11912699-B2 Tau-protein targeting compounds and associated ARVINAS OPERATIONS, INC. (US) 2024-02-27 — — US disclosed
US-20230365562-A1 IRAK DEGRADERS AND USES THEREOF KYMERA THERAPEUTICS, INC. 2023-11-16 — — US disclosed
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS WILMINGTON TRUST, NATIONAL ASSOCIATION, AS AGENT 2023-07-27 — — US disclosed
US-20230210999-A1 TARGETED PROTEASE DEGRADATION (TED) PLATFORM EUBULUS BIOTHERAPEUTICS (HONG KONG) LIMITED (HK) 2023-07-06 — — US disclosed
US-20200102323-A1 ACC INHIBITORS AND USES THEREOF SCHRÖDINGER, INC. 2020-04-02 — — US disclosed
WO-2019023575-A1 IMMUNOMODULATOR COMPOUNDS CHEMOCENTRYX, INC. (US) 2019-01-31 — — WO disclosed
US-10174035-B2 6-morpholinyl-2-pyrazolyl-9H-purine derivatives and their use as PI3K inhibitors DAIICHI SANKYO COMPANY, LIMITED (JP) 2019-01-08 — — US disclosed
US-20180072732-A1 6-MORPHOLINYL-2-PYRAZOLYL-9H-PURINE DERIVATIVES AND THEIR USE AS PI3K INHIBITORS DAIICHI SANKYO COMPANY, LIMITED (JP) 2018-03-15 — — 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 (7 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-20200102323-A1 ACC INHIBITORS AND USES THEREOF ACACA, ACACB, ACAT2 ALDH1A1 104/4885MAPK1 3159/4885L3MBTL1 2864/4885
US-20230365562-A1 IRAK DEGRADERS AND USES THEREOF IRAK2, IRAK3, IRAK1 ALDH1A1 2776/4885MAPK1 2017/4885L3MBTL1 1394/4885
US-11912699-B2 Tau-protein targeting compounds and associated MAPT, VHL, CRBN ALDH1A1 3804/4885MAPK1 3144/4885L3MBTL1 1412/4885
US-20230210999-A1 TARGETED PROTEASE DEGRADATION (TED) PLATFORM UCHL3, UBE2L3, ADAM33 ALDH1A1 2539/4885MAPK1 3542/4885L3MBTL1 480/4885
US-10174035-B2 6-morpholinyl-2-pyrazolyl-9H-purine derivatives and their use as PI3K inhibitors PIK3CA, AKT3, AKT2 ALDH1A1 2619/4885MAPK1 102/4885L3MBTL1 4036/4885
US-20230233569-A1 METHODS FOR DELAYING, PREVENTING, AND TREATING ACQUIRED RESISTANCE TO RAS INHIBITORS KRAS, HRAS, MTOR ALDH1A1 4528/4885MAPK1 769/4885L3MBTL1 1005/4885
US-20180072732-A1 6-MORPHOLINYL-2-PYRAZOLYL-9H-PURINE DERIVATIVES AND THEIR USE AS PI3K INHIBITORS PIK3CA, AKT3, AKT2 ALDH1A1 2619/4885MAPK1 102/4885L3MBTL1 4036/4885

“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.

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