SCHEMBL19862242

SCHEMBL19862242

C1=Cc2ccc(-c3cc(-c4cccnc4)nc(-c4ccccc4)n3)cc2C2(c3ccccc31)c1ccccc1-c1c2ccc2oc3ccccc3c12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDK2 Q15119 4/20 0.35
CYP19A1 P11511 1/20 0.33
DHODH Q02127 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
ALDH1A1 P00352 4/20 0.32
MEN1 O00255 2/20 0.32
TSHR P16473 2/20 0.32
KMT2A Q03164 2/20 0.32
MAPT P10636 2/20 0.32
ALOX12 P18054 1/20 0.32
MAPK1 P28482 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HSD17B10 Q99714 1/20 0.32
PIM1 P11309 1/20 0.32
PIM2 Q9P1W9 1/20 0.32
CYP1A2 P05177 2/20 0.31
CYP3A4 P08684 2/20 0.31
CYP2C9 P11712 2/20 0.31
GAA P10253 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL19862247 0.97 PDK2 (0.35) PDK2CYP19A1DHODHGPR84ALDH1A1
SCHEMBL19862246 0.97 DHODH (0.35) PDK2CYP19A1DHODHALDH1A1MEN1
SCHEMBL19862243 0.97 DHODH (0.35) PDK2CYP19A1DHODHALDH1A1MEN1
SCHEMBL19862248 0.96 PDK2 (0.33) PDK2CYP19A1DHODHGPR84ALDH1A1
SCHEMBL19862251 0.95 DHODH (0.36) PDK2CYP19A1DHODHGPR84ALDH1A1
SCHEMBL19862240 0.94 PDK2 (0.35) PDK2CYP19A1DHODHGPR84ALDH1A1
SCHEMBL19862250 0.94 HDAC6 (0.33) PDK2CYP19A1DHODHGPR84
SCHEMBL19862255 0.94 HDAC6 (0.33) PDK2CYP19A1DHODHGPR84
SCHEMBL19862238 0.92 KMT2A (0.33) ALDH1A1MEN1KMT2AMAPTMAPK1
SCHEMBL19862249 0.90 KMT2A (0.32) ALDH1A1MEN1KMT2AMAPTMAPK1

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
US-10454039-B2 Compound and organic electronic device using the same SHANGHAI NICHEM FINE CHEMICAL CO., LTD. (CN) 2019-10-22 US disclosed
US-20180047918-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-02-15 US disclosed
US-20180047918-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME NICHEM FINE TECHNOLOGY CO., LTD. (TW) 2018-02-15 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-20180047918-A1 COMPOUND AND ORGANIC ELECTRONIC DEVICE USING THE SAME ORC3, AOX1, RCOR3 PDK2 2964/4885CYP19A1 371/4885DHODH 1612/4885
US-10454039-B2 Compound and organic electronic device using the same ORC3, AOX1, RCOR3 PDK2 2964/4885CYP19A1 371/4885DHODH 1612/4885

“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.