SCHEMBL19650615

SCHEMBL19650615

c1ccc(-c2cc(-c3cccc4c(-c5ccc(-c6cccnc6)cc5)cccc34)nc(-c3ccccc3)n2)cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 1/20 0.53
CYP19A1 P11511 2/20 0.51
TNF P01375 1/20 0.47
CYP11B1 P15538 2/20 0.46
ALDH1A1 P00352 6/20 0.45
MAPT P10636 5/20 0.45
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
HPGD P15428 4/20 0.45
NTSR1 P30989 1/20 0.45
GLA P06280 3/20 0.45
TSHR P16473 2/20 0.45
CYP1A2 P05177 2/20 0.45
CYP3A4 P08684 2/20 0.45
CYP2D6 P10635 2/20 0.45
CYP2C9 P11712 2/20 0.45
CLK4 Q9HAZ1 2/20 0.45
CYP17A1 P05093 1/20 0.44
CYP11B2 P19099 1/20 0.44
KDM4E B2RXH2 4/20 0.44

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
SCHEMBL23095094 0.95 DHODH (0.49) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL19637976 0.95 ALDH1A1 (0.51) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL19637994 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL30296928 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL17918140 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL19528974 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL19397376 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL17917886 0.93 TNF (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL23095071 0.93 ALDH1A1 (0.52) DHODHCYP19A1TNFCYP11B1ALDH1A1
SCHEMBL29776775 0.92 ALDH1A1 (0.53) DHODHCYP19A1TNFCYP11B1ALDH1A1

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 3 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
US-10566543-B2 Pyrimidine derivative and organic electroluminescent devices HODOGAYA CHEMICAL CO., LTD. (JP) 2020-02-18 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 (1 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-10566543-B2 Pyrimidine derivative and organic electroluminescent devices TYMS, TYMP, DPYD DHODH 20/4885CYP19A1 1706/4885TNF 2244/4885

“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.