SCHEMBL21836282

SCHEMBL21836282

CC(NC(c1ccccc1)c1ccccc1)c1ccc(Cl)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
AKT1 P31749 1/20 0.47
ADRB2 P07550 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
SLC6A2 P23975 3/20 0.45
SLC6A4 P31645 3/20 0.45
CHRM1 P11229 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
SLC6A3 Q01959 2/20 0.45
CHRM2 P08172 1/20 0.45
HTR1A P08908 1/20 0.45
ADRA2A P08913 1/20 0.45
BCL2 P10415 1/20 0.45
DRD1 P21728 1/20 0.45
TBXA2R P21731 1/20 0.45
ADRA1A P35348 1/20 0.45
DRD3 P35462 1/20 0.45
KCNH2 Q12809 1/20 0.45
HRH3 Q9Y5N1 1/20 0.45

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
SCHEMBL21836281 1.00 MEN1 (0.52) MEN1KMT2AAKT1ADRB2SIGMAR1
SCHEMBL21836227 0.88 SIGMAR1 (0.55) MEN1KMT2ASIGMAR1SLC6A2SLC6A4
SCHEMBL21836226 0.88 SIGMAR1 (0.55) MEN1KMT2ASIGMAR1SLC6A2SLC6A4
SCHEMBL7787460 0.86 MEN1 (0.43) MEN1KMT2AAKT1ADRB2SLC6A2
SCHEMBL9511748 0.86 IDO1 (0.52) MEN1KMT2AAKT1SLC6A2SLC6A4
SCHEMBL7785084 0.81 CRHBP (0.47) MEN1KMT2ASLC6A2SLC6A4TDP1
SCHEMBL21836231 0.78 ALDH1A1 (0.62) MEN1KMT2ATDP1
SCHEMBL21836229 0.78 ALDH1A1 (0.62) MEN1KMT2ATDP1
SCHEMBL4759648 0.78 SLC6A4 (0.50) MEN1KMT2AAKT1SLC6A2SLC6A4
SCHEMBL10315779 0.77 ADRB2 (0.56) AKT1ADRB2SLC6A2SLC6A4TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12129249-B2 Method for producing optically active compound DAY ONE BIOPHARMACEUTICALS, INC. (US) 2024-10-29 US disclosed
EP-4406609-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Day One Biopharmaceuticals, Inc. (US) 2024-07-31 EP disclosed
CN-117447464-A Method for producing optically active compound 首日生物制药公司 2024-01-26 CN disclosed
CN-111032047-B Method for producing optically active compound 多特疗法-1公司 2023-10-27 CN disclosed
US-20210347769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS, INC. 2021-11-11 US disclosed
US-10988469-B2 Method for producing optically active compound DOT THERAPEUTICS-1, INC. (US) 2021-04-27 US disclosed
US-20200317659-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DAY ONE BIOPHARMACEUTICALS, INC. 2020-10-08 US disclosed
CN-111032047-A Process for producing optically active compound 千年制药公司 2020-04-17 CN disclosed
EP-3632441-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Millennium Pharmaceuticals, Inc. (US) 2020-04-08 EP disclosed
EP-3632441-A2 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND Millennium Pharmaceuticals, Inc. (US) 2020-04-08 EP 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 (4 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-10988469-B2 Method for producing optically active compound DHPS, QDPR, SPR MEN1 1696/4885KMT2A 504/4885AKT1 1603/4885
US-20200317659-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR MEN1 1696/4885KMT2A 504/4885AKT1 1603/4885
US-12129249-B2 Method for producing optically active compound DHPS, QDPR, SPR MEN1 1696/4885KMT2A 504/4885AKT1 1603/4885
US-20210347769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR MEN1 1696/4885KMT2A 504/4885AKT1 1603/4885

“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.