SCHEMBL19638034

SCHEMBL19638034

c1ccc(-c2ccc(-c3nc(-c4ccccc4)cc(-c4ccc(-c5ccc(-c6cccnc6)cc5)cc4)n3)cc2)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP19A1 P11511 2/20 0.66
ALDH1A1 P00352 6/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
MAPT P10636 3/20 0.58
HPGD P15428 3/20 0.58
NTSR1 P30989 1/20 0.58
DHODH Q02127 1/20 0.57
CYP17A1 P05093 1/20 0.56
CYP11B1 P15538 1/20 0.56
CYP11B2 P19099 1/20 0.56
MKNK1 Q9BUB5 2/20 0.54
MKNK2 Q9HBH9 2/20 0.54
CYP2A6 P11509 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP1A2 P05177 1/20 0.54
KDM4E B2RXH2 4/20 0.53
SMN1; SMN2 Q16637 3/20 0.53
TP53 P04637 2/20 0.53
RAB9A P51151 2/20 0.53

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
SCHEMBL24527291 1.00 CYP19A1 (0.66) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL17945297 1.00 CYP19A1 (0.66) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL28674039 0.97 CYP19A1 (0.67) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL24590289 0.96 CYP19A1 (0.71) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL21623613 0.96 CYP19A1 (0.71) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL21709035 0.96 CYP19A1 (0.59) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL24252576 0.95 CYP19A1 (0.60) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL19397372 0.95 CYP19A1 (0.60) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL19486671 0.95 CYP19A1 (0.65) CYP19A1ALDH1A1MEN1KMT2AMAPT
SCHEMBL19486658 0.95 CYP19A1 (0.65) CYP19A1ALDH1A1MEN1KMT2AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3248966-B1 PYRIMIDINE DERIVATIVES AND ORGANIC ELECTROLUMINESCENT DEVICES HODOGAYA CHEMICAL CO LTD (JP) 2022-12-21 EP disclosed
EP-3355376-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2021-12-01 EP disclosed
US-10950797-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2021-03-16 US disclosed
US-10950797-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2021-03-16 US disclosed
CN-107406415-B Pyrimidine derivative and organic electroluminescent device 保土谷化学工业株式会社 2021-02-19 CN disclosed
CN-108292708-B Organic electroluminescent device 保土谷化学工业株式会社 2020-03-03 CN disclosed
US-10566543-B2 Pyrimidine derivative and organic electroluminescent devices HODOGAYA CHEMICAL CO., LTD. (JP) 2020-02-18 US disclosed
US-10566543-B2 Pyrimidine derivative and organic electroluminescent devices HODOGAYA CHEMICAL CO., LTD. (JP) 2020-02-18 US disclosed
US-20180294416-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2018-10-11 US disclosed
EP-3355376-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2018-08-01 EP disclosed
US-20180006239-A1 PYRIMIDINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICES HODOGAYA CHEMICAL CO., LTD. (JP) 2018-01-04 US disclosed
US-20180006239-A1 PYRIMIDINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICES HODOGAYA CHEMICAL CO., LTD. (JP) 2018-01-04 US disclosed
EP-3248966-A1 PYRIMIDINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENCE ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2017-11-29 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-20180006239-A1 PYRIMIDINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT DEVICES TYMS, TYMP, DPYD CYP19A1 1706/4885ALDH1A1 582/4885MEN1 4184/4885
US-10566543-B2 Pyrimidine derivative and organic electroluminescent devices TYMS, TYMP, DPYD CYP19A1 1706/4885ALDH1A1 582/4885MEN1 4184/4885
US-20180294416-A1 ORGANIC ELECTROLUMINESCENT DEVICE SLC29A2, SLC29A1, NUDT1 CYP19A1 1301/4885ALDH1A1 427/4885MEN1 3587/4885
US-10950797-B2 Organic electroluminescent device SLC29A2, SLC29A1, NUDT1 CYP19A1 1301/4885ALDH1A1 427/4885MEN1 3587/4885

“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.