SCHEMBL25722706

SCHEMBL25722706

CN(C)c1c(C(F)(F)F)cccc1C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.40
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
POLB P06746 1/20 0.40
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 2/20 0.40
TSHR P16473 2/20 0.40
MAPK1 P28482 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX15 P16050 1/20 0.40
HIF1A Q16665 1/20 0.40
AXL P30530 1/20 0.39
P2RX7 Q99572 1/20 0.38
CYP2D6 P10635 2/20 0.38
CLK4 Q9HAZ1 2/20 0.38
CYP2C9 P11712 1/20 0.38
ACP1 P24666 1/20 0.37
POLQ O75417 1/20 0.36
METAP1 P53582 1/20 0.36
HSD11B1 P28845 2/20 0.35

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
SCHEMBL20329554 0.87 GABRA1 (0.36) TDP1ALDH1A1CYP1A2CYP3A4TSHR
SCHEMBL25005922 0.87 HSD11B1 (0.38) TDP1CYP1A2CYP3A4TSHRMAPK1
SCHEMBL22662731 0.85 CYP1A2 (0.35) TDP1ALDH1A1L3MBTL1POLBCYP1A2
SCHEMBL22662730 0.85 TSHR (0.35) TDP1ALDH1A1L3MBTL1POLBCYP1A2
SCHEMBL19130451 0.82 P2RX7 (0.46) TDP1CYP1A2CYP3A4TSHRMAPK1
SCHEMBL24655960 0.82 AR (0.41) ALDH1A1CYP3A4TSHRMAPK1HSD17B10
SCHEMBL6646568 0.80 AR (0.43) TDP1ALDH1A1L3MBTL1KDM4E
SCHEMBL6646950 0.79 TAS2R14 (0.50) ALDH1A1HSD17B10ALOX15POLQKDM4E
SCHEMBL5376004 0.77 CA2 (0.50) TDP1ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL23351603 0.74 P2RX7 (0.40) CYP1A2P2RX7CYP2D6CLK4CYP2C9

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-20230200211-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-22 US disclosed
US-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2023-06-01 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-20230167145-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD1, OCIAD2, OSBP TDP1 1863/4885ALDH1A1 263/4885L3MBTL1 104/4885
US-20230200211-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OPRM1, OCIAD1 TDP1 3956/4885ALDH1A1 412/4885L3MBTL1 1660/4885

“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.