SCHEMBL19912433

SCHEMBL19912433

Cc1ccc(-c2ccc3c(c2)c2ccccc2n3-c2cc(-c3cc(C)cc(C(F)(F)F)c3)c(-n3c4ccccc4c4cc(-c5ccccc5)ccc43)cc2C#N)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 3/20 0.38
XDH P47989 1/20 0.33
PTPN5 P54829 1/20 0.32
PDE9A O76083 1/20 0.32
PDE1C Q14123 1/20 0.32
ADORA1 P30542 2/20 0.32
ADORA2B P29275 1/20 0.32
TSPO P30536 1/20 0.31
NPSR1 Q6W5P4 2/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
PPARG P37231 1/20 0.31
NCOA2 Q15596 1/20 0.31
NCOA1 Q15788 1/20 0.31
NCOA3 Q9Y6Q9 1/20 0.31
ADORA2A P29274 1/20 0.31
ICMT O60725 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 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
SCHEMBL19912419 0.98 AR (0.38) ARXDHTSPONPSR1CYP1A2
SCHEMBL19917912 0.96 AR (0.40) ARXDHPTPN5PDE9APDE1C
SCHEMBL19912416 0.96 AR (0.39) ARXDH
SCHEMBL19912445 0.94 AR (0.37) ARXDHICMT
SCHEMBL19912430 0.94 AR (0.43) ARXDHICMT
SCHEMBL22822289 0.94 AR (0.38) ARXDHPTPN5PDE9APDE1C
SCHEMBL19912429 0.94 AR (0.44) ARXDHPTPN5ADORA1KDM4E
SCHEMBL19912440 0.93 AR (0.36) ARXDHICMT
SCHEMBL19912437 0.93 AR (0.40) ARXDHPTPN5PDE9APDE1C
SCHEMBL19912421 0.93 AR (0.38) ARXDHNPSR1CYP1A2CYP2C9

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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2018-03-01 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 (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-20180062086-A1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES OR10J3, ORC3, AOC3 AR 4212/4885XDH 68/4885PTPN5 3658/4885

“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.