SCHEMBL28801415

SCHEMBL28801415

COc1cc(NCCN)cc(OC)c1OC

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR2A P28223 1/20 0.53
HTR2C P28335 1/20 0.53
HTR2B P41595 1/20 0.53
PRKD3 O94806 1/20 0.46
EGFR P00533 1/20 0.46
PRKCG P05129 1/20 0.46
PRKCB P05771 1/20 0.46
LCK P06239 1/20 0.46
PRKCA P17252 1/20 0.46
PRKCH P24723 1/20 0.46
PRKCI P41743 1/20 0.46
ZAP70 P43403 1/20 0.46
PRKCE Q02156 1/20 0.46
PRKCQ Q04759 1/20 0.46
PRKCZ Q05513 1/20 0.46
PRKCD Q05655 1/20 0.46
PRKD1 Q15139 1/20 0.46
PTGS2 P35354 1/20 0.44
TUBB4A P04350 1/20 0.44
TUBB P07437 1/20 0.44

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
SCHEMBL11935032 0.86 RAD52 (0.52) HTR2AHTR2CHTR2BPTGS2TUBB4A
SCHEMBL12963092 0.82 PTGS2 (0.50) PTGS2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL4587193 0.81 PTGS2 (0.44) HTR2AHTR2CHTR2BPTGS2TUBB4A
SCHEMBL9525237 0.81 CYP3A4 (0.47) PTGS2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL10845913 0.79 KDM4E (0.51) CYP1A2CA9CA1CA2MAPT
SCHEMBL2759516 0.78 PTGS2 (0.54) HTR2AHTR2CHTR2BPTGS2TUBB4A
SCHEMBL6142613 0.77 ALDH1A1 (0.49) CYP3A4MAPT
SCHEMBL23011878 0.76 MAPT (0.50) PTGS2TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5537261 0.76 PTGS2 (0.47) HTR2AHTR2CHTR2BPTGS2TUBB4A
SCHEMBL14195838 0.76 PTGS2 (0.47) HTR2AHTR2CHTR2BPTGS2TUBB4A

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
CN-120463623-A Preparation and application of D-pi-A molecular motor 桂林理工大学 2025-08-12 CN disclosed
CN-101889961-B Cosmetic or dermatological composition OREAL 2013-02-20 CN disclosed