SCHEMBL21022949

SCHEMBL21022949

Cc1c(-c2nc3ccccc3n2C)ccnc1-c1ccccn1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 1/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
KDR P35968 4/20 0.46
PTK2 Q05397 4/20 0.46
PLK1 P53350 2/20 0.46
METAP2 P50579 1/20 0.46
METAP1 P53582 1/20 0.46
AURKB Q96GD4 1/20 0.46
CA12 O43570 1/20 0.44
CA9 Q16790 1/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
KDM4E B2RXH2 5/20 0.43
NPC1 O15118 4/20 0.43
AKT1 P31749 1/20 0.43
ALDH1A1 P00352 4/20 0.43
RAB9A P51151 3/20 0.43
GAA P10253 2/20 0.43
HSD17B10 Q99714 2/20 0.43
PKM P14618 2/20 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
SCHEMBL21022945 0.84 CYP19A1 (0.49) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL172248 0.81 CYP19A1 (0.61) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL27555515 0.76 KDM4E (0.50) METAP1L3MBTL1KDM4ENPC1ALDH1A1
SCHEMBL4814275 0.76 CYP19A1 (0.56) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL21022946 0.75 CYP19A1 (0.54) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL26512203 0.73 MEN1 (0.55) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL1533926 0.73 MEN1 (0.55) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL13239249 0.73 KDR (0.58) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL1534259 0.72 MEN1 (0.52) CYP19A1MEN1KMT2AKDRPTK2
SCHEMBL1171430 0.71 MEN1 (0.69) MEN1KMT2AMETAP2METAP1L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11168103-B2 Organic electroluminescent materials and devices UNIVERSAL DISPLAY CORPORATION (US) 2021-11-09 US disclosed
US-20190153009-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION 2019-05-23 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 (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-20190153009-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES CHRM4, CHRM1, OPRD1 CYP19A1 1968/4885MEN1 3730/4885KMT2A 3068/4885
US-11168103-B2 Organic electroluminescent materials and devices OCIAD1, OCIAD2, OR10J3 CYP19A1 2979/4885MEN1 3746/4885KMT2A 2078/4885

“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.