SCHEMBL16622848

SCHEMBL16622848

Cc1cc(C(=O)NC2CCC(C)CC2)cc(C(=O)NC2CCC(C)CC2)c1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 5/20 0.57
TAS1R1 Q7RTX1 5/20 0.57
TAS1R2 Q8TE23 5/20 0.57
NPC1 O15118 11/20 0.55
RAB9A P51151 9/20 0.55
KMT2A Q03164 1/20 0.55
POLB P06746 1/20 0.53
SMYD3 Q9H7B4 1/20 0.52
F2 P00734 1/20 0.51
PLG P00747 1/20 0.51
PRSS1 P07477 1/20 0.51
PRSS2 P07478 1/20 0.51
PRSS3 P35030 1/20 0.51
ST14 Q9Y5Y6 1/20 0.51
CYP1A2 P05177 1/20 0.50
HPGD P15428 1/20 0.50
CYP2C19 P33261 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
LMNA P02545 1/20 0.50
CNR1 P21554 1/20 0.47

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
SCHEMBL2452125 0.93 NPC1 (0.60) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL30947791 0.86 NPC1 (0.55) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL18902161 0.86 NPC1 (0.53) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL16622850 0.86 RAB9A (0.69) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL22229473 0.85 F2 (0.56) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL16622859 0.84 NPC1 (0.71) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL16622857 0.84 NPC1 (0.71) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL16622854 0.84 NPC1 (0.71) TAS1R3TAS1R1TAS1R2NPC1RAB9A
SCHEMBL2909582 0.83 RAB9A (0.57) NPC1RAB9AKMT2ASMYD3CYP1A2
SCHEMBL14574042 0.83 SMYD3 (0.66) TAS1R3TAS1R1TAS1R2NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9882136-B2 Organic electroluminescent device HODOGAYA CHEMICAL CO., LTD. (JP) 2018-01-30 US disclosed
EP-2858458-B1 ORGANIC ELECTROLUMINESCENT ELEMENT HODOGAYA CHEMICAL CO LTD (JP) 2017-05-31 EP disclosed
US-20150287920-A1 ORGANIC ELECTROLUMINESCENT DEVICE HODOGAYA CHEMICAL CO., LTD. (JP) 2015-10-08 US disclosed
EP-2858458-A1 ORGANIC ELECTROLUMINESCENT ELEMENT Hodogaya Chemical Co., Ltd. (JP) 2015-04-08 EP 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-20150287920-A1 ORGANIC ELECTROLUMINESCENT DEVICE CDH1, STRA6, SLC39A7 TAS1R3 3567/4885TAS1R1 2190/4885TAS1R2 2636/4885

“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.