SCHEMBL23029158

SCHEMBL23029158

FC(F)(F)c1ccc(N(c2ccc(C(F)(F)F)cc2)c2ccc3cc4c5ccc(N(c6ccc(C(F)(F)F)cc6)c6ccc(C(F)(F)F)cc6)cc5n(-c5ccc6ccccc6c5)c4cc3c2)cc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KIF11 P52732 2/20 0.34
▸ SLC6A2 P23975 1/20 0.34
▸ SLC6A4 P31645 1/20 0.34
▸ MAPK9 P45984 3/20 0.33
▸ MAPK10 P53779 3/20 0.33
▸ MAT2A P31153 2/20 0.33
▸ MAPK8 P45983 1/20 0.33
▸ CYP19A1 P11511 1/20 0.32
▸ TRPV1 Q8NER1 1/20 0.32
▸ ESR1 P03372 1/20 0.31
▸ HTR7 P34969 1/20 0.31
▸ PPARG P37231 2/20 0.31
▸ PPARA Q07869 1/20 0.31
▸ PLA2G10 O15496 1/20 0.31
▸ TDP2 O95551 1/20 0.30
▸ HTR3E A5X5Y0 1/20 0.30
▸ HTR3B O95264 1/20 0.30
▸ HTR3A P46098 1/20 0.30
▸ HTR5A P47898 1/20 0.30
▸ HTR3D Q70Z44 1/20 0.30

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
SCHEMBL21452045 0.91 PLA2G10 (0.35) KIF11MAT2AESR1PPARGPPARA
SCHEMBL23029146 0.87 PLA2G10 (0.32) MAT2APPARGPPARAPLA2G10
SCHEMBL23029155 0.85 CYP1A2 (0.34) SLC6A2SLC6A4MAPK9MAPK10MAT2A
SCHEMBL21452052 0.84 DHFR (0.36) KIF11MAT2AESR1PPARGTDP2
SCHEMBL23029118 0.83 MAPK10 (0.34) MAPK9MAPK10MAPK8ESR1HTR3E
SCHEMBL21452046 0.83 CYP1A2 (0.33) MAPK9MAPK10MAT2AMAPK8
SCHEMBL21452118 0.82 MAT2A (0.34) KIF11MAT2AESR1PPARGPPARA
SCHEMBL21452036 0.81 KDM4E (0.39) MAT2A
SCHEMBL23029043 0.81 KDM4E (0.41) MAT2A
SCHEMBL22302486 0.81 MAPK10 (0.36) MAPK9MAPK10MAPK8CYP19A1HTR3E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME LG CHEM, LTD. (KR) 2021-02-25 — — 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 (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-20210057650-A1 AMINE COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING SAME DRD1, RNF10, DRD2 KIF11 437/4885SLC6A2 974/4885SLC6A4 859/4885

“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.

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