SCHEMBL21836280

SCHEMBL21836280

CC(=NC(c1ccccc1)c1ccccc1)c1ccccn1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.58
SMN1; SMN2 Q16637 5/20 0.55
LMNA P02545 4/20 0.55
MITF O75030 1/20 0.55
SLC2A1 P11166 1/20 0.52
ALDH1A1 P00352 3/20 0.47
TOP2A P11388 2/20 0.45
RAB9A P51151 5/20 0.44
NPC1 O15118 4/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
NAPRT Q6XQN6 1/20 0.44
P4HTM Q9NXG6 1/20 0.44
AGTR1 P30556 2/20 0.43
PKM P14618 1/20 0.43
TDP1 Q9NUW8 2/20 0.43
MEN1 O00255 2/20 0.43
GAA P10253 2/20 0.43
MAPT P10636 2/20 0.43
KMT2A Q03164 2/20 0.43
ALOX12 P18054 1/20 0.43

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
SCHEMBL21836279 1.00 KDM4E (0.58) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL16471838 0.85 KDM4E (0.56) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL14280796 0.82 NOS2 (0.38) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL241811 0.80 KDM4E (0.63) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL241812 0.80 KDM4E (0.63) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL16471836 0.79 KDM4E (0.53) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL1256130 0.75 KDM4E (0.73) KDM4ESMN1; SMN2LMNAMITFALDH1A1
SCHEMBL13197267 0.75 KDM4E (0.56) KDM4ESMN1; SMN2LMNAMITFSLC2A1
SCHEMBL3660657 0.74 KDM4E (1.00) KDM4ESMN1; SMN2LMNAMITFALDH1A1
SCHEMBL19386605 0.74 KDM4E (0.70) KDM4ESMN1; SMN2LMNAMITFALDH1A1

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 7 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
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

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 KDM4E 913/4885SMN1; SMN2 2875/4885LMNA 3508/4885
US-20200317659-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR KDM4E 913/4885SMN1; SMN2 2875/4885LMNA 3508/4885
US-12129249-B2 Method for producing optically active compound DHPS, QDPR, SPR KDM4E 913/4885SMN1; SMN2 2875/4885LMNA 3508/4885
US-20210347769-A1 METHOD FOR PRODUCING OPTICALLY ACTIVE COMPOUND DHPS, QDPR, SPR KDM4E 913/4885SMN1; SMN2 2875/4885LMNA 3508/4885

“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.