SCHEMBL21968643

SCHEMBL21968643

c1ccc(N(c2ccccc2)c2ccc3c(c2)oc2cc(N(c4ccc(-c5ccc6ccccc6c5)cc4)c4ccc5c(c4)oc4ccccc45)ccc23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 1/20 0.40
AHR P35869 2/20 0.40
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
MMP12 P39900 1/20 0.39
MMP13 P45452 1/20 0.39
ESR1 P03372 2/20 0.38
ESR2 Q92731 2/20 0.38
CYP1A1 P04798 1/20 0.37
CYP1B1 Q16678 1/20 0.37
PGR P06401 1/20 0.36
ACMSD Q8TDX5 1/20 0.35
PLA2G2A P14555 2/20 0.35
PLA2G4A P47712 2/20 0.35
TNKS O95271 1/20 0.35
CASP3 P42574 1/20 0.34

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
SCHEMBL18326955 1.00 HCRTR1 (0.40) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL27274180 1.00 HCRTR1 (0.40) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL27273424 0.99 HCRTR1 (0.39) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL27273425 0.97 HCRTR1 (0.38) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL27274198 0.97 HCRTR1 (0.40) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL18326960 0.97 HCRTR1 (0.40) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL18198877 0.97 AHR (0.41) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL18371298 0.97 AHR (0.41) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL23225312 0.96 HCRTR1 (0.40) HCRTR1AHRMEN1MAPTKMT2A
SCHEMBL24841349 0.96 PLA2G2A (0.39) HCRTR1AHRMEN1MAPTKMT2A

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-20200176685-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-06-04 US disclosed
US-20200144510-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-07 US disclosed
US-20200144508-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE SAMSUNG SDI CO., LTD. (KR) 2020-05-07 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-20200144508-A1 ORGANIC OPTOELECTRONIC DEVICE AND DISPLAY DEVICE OCIAD1, OCIAD2, OR10J3 HCRTR1 518/4885AHR 1950/4885MEN1 3756/4885

“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.