SCHEMBL20511652

SCHEMBL20511652

CC(C)(C)OC(=O)n1cc(-c2ccccc2B2OC(C)(C)C(C)(C)O2)cn1

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.42
ROCK2 O75116 1/20 0.40
USP30 Q70CQ3 2/20 0.36
LIPE Q05469 5/20 0.34
SCN9A Q15858 2/20 0.34
FFAR1 O14842 1/20 0.34
RET P07949 1/20 0.34
UCHL1 P09936 1/20 0.33
PRMT5 O14744 1/20 0.32
WDR77 Q9BQA1 1/20 0.32
BUB1 O43683 1/20 0.32

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
SCHEMBL3085374 0.81 ROCK2 (0.49) SCDROCK2USP30FFAR1PRMT5
SCHEMBL3089708 0.80 SCD (0.43) SCDROCK2USP30FFAR1RET
SCHEMBL30483039 0.80 SCD (0.43) SCDROCK2USP30FFAR1RET
SCHEMBL29998967 0.79 ROCK2 (0.38) SCDROCK2USP30SCN9AFFAR1
SCHEMBL15476193 0.79 ROCK2 (0.38) SCDROCK2USP30SCN9AFFAR1
SCHEMBL141413 0.78 FFAR1 (0.52) SCDROCK2USP30FFAR1UCHL1
SCHEMBL31627089 0.78 PDPK1 (0.39) SCDPRMT5WDR77
SCHEMBL22165763 0.77 ROCK2 (0.48) SCDROCK2SCN9A
SCHEMBL20509718 0.77 ROCK2 (0.48) SCDROCK2SCN9ARETUCHL1
SCHEMBL32685024 0.76 SCD (0.39) SCDUSP30LIPEPRMT5WDR77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240083857-A1 2-Methyl-Quinazolines Bayer Pharma AG (DE) 2024-03-14 US disclosed
US-20220235013-A1 2-METHYL-QUINAZOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2022-07-28 US disclosed
EP-3601267-A1 2-METHYL-QUINAZOLINES Bayer Pharma Aktiengesellschaft (DE) 2020-02-05 EP disclosed
WO-2018172250-A1 2-METHYL-QUINAZOLINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-09-27 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 (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-20240083857-A1 2-Methyl-Quinazolines NRAS, KRAS, KSR2 SCD 4877/4885ROCK2 332/4885USP30 4053/4885
US-20220235013-A1 2-METHYL-QUINAZOLINES NRAS, KRAS, KSR2 SCD 4877/4885ROCK2 332/4885USP30 4053/4885

“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.