SCHEMBL18552020

SCHEMBL18552020

c1ccc2c(-c3ccc(-c4ccc(-c5ccc6[nH]cc(-c7ccc(-c8ccc(-c9cccc%10ccccc9%10)cc8)cc7)c6c5)cc4)cc3)cccc2c1

nearest known ligand 0.49

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 1/20 0.49
CA12 O43570 2/20 0.48
CA1 P00915 2/20 0.48
CA2 P00918 2/20 0.48
CA9 Q16790 2/20 0.48
PIM1 P11309 5/20 0.46
PIM3 Q86V86 5/20 0.46
TDO2 P48775 4/20 0.46
IMPDH2 P12268 2/20 0.46
MAPK1 P28482 1/20 0.45
HSD17B10 Q99714 1/20 0.45
PDGFRB P09619 1/20 0.44
PDGFRA P16234 1/20 0.44
PIM2 Q9P1W9 3/20 0.44
ALOX5 P09917 1/20 0.43
MCL1 Q07820 1/20 0.43
ALK Q9UM73 1/20 0.42
ASH1L Q9NR48 1/20 0.41

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
SCHEMBL24022670 0.97 PIM1 (0.50) NR4A2CA12CA1CA2CA9
SCHEMBL18552205 0.89 TDO2 (0.47) NR4A2PIM1PIM3TDO2PDGFRB
SCHEMBL18552017 0.84 NR4A2 (0.49) NR4A2PIM1PIM3TDO2IMPDH2
SCHEMBL18552202 0.84 TDO2 (0.51) NR4A2PIM1PIM3TDO2IMPDH2
SCHEMBL18552149 0.83 IMPDH2 (0.61) NR4A2PIM1PIM3IMPDH2MAPK1
SCHEMBL24022684 0.83 IMPDH2 (0.61) NR4A2PIM1PIM3IMPDH2MAPK1
SCHEMBL18552198 0.83 IMPDH2 (0.61) NR4A2PIM1PIM3IMPDH2MAPK1
SCHEMBL17154795 0.82 CA12 (0.51) CA12CA1CA2CA9HSD17B10
SCHEMBL18428557 0.79 CA12 (0.49) CA12CA1CA2CA9HSD17B10
SCHEMBL30030358 0.79 CA12 (0.49) CA12CA1CA2CA9HSD17B10

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-11177443-B2 Compound and light emitting diode including same LMS CO., LTD (KR) 2021-11-16 US disclosed
WO-2017030424-A1 NOVEL COMPOUND AND LIGHT EMITTING DIODE INCLUDING SAME 주식회사 엘엠에스 2017-02-23 WO 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-11177443-B2 Compound and light emitting diode including same ARL1, ALDH1A2, DRD1 NR4A2 646/4885CA12 3413/4885CA1 2902/4885

“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.