SCHEMBL29785802

SCHEMBL29785802

C1=CC2(CCOc3ccccc3-c3ccccc3)CCC1C2

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.44
MAPK1 P28482 1/20 0.44
RAB9A P51151 1/20 0.44
HTR7 P34969 1/20 0.43
ADRB2 P07550 4/20 0.41
LMNA P02545 4/20 0.40
HTT P42858 3/20 0.40
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
KDM4E B2RXH2 6/20 0.39
ADRB1 P08588 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.39
ALDH1A1 P00352 4/20 0.39
L3MBTL1 Q9Y468 1/20 0.38
PKM P14618 1/20 0.38

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
SCHEMBL30001188 0.87 HTR7 (0.41) TP53MAPK1RAB9AHTR7ADRB2
SCHEMBL17912773 0.82 KCNA3 (0.39) MAPK1RAB9AKMT2ASMN1; SMN2ALDH1A1
SCHEMBL155264 0.72 RAB9A (0.35) RAB9AMEN1KMT2AKDM4EPOLB
SCHEMBL20362195 0.72
SCHEMBL650713 0.72 KDM1A (0.41) SMN1; SMN2ALDH1A1
SCHEMBL7120876 0.70
SCHEMBL13739595 0.70 TP53 (0.74) TP53MAPK1RAB9AHTR7ADRB2
SCHEMBL20362170 0.69 OPRM1 (0.36) TP53MEN1KMT2A
SCHEMBL9792899 0.69 SLC6A2 (0.31)
SCHEMBL1739200 0.68 FOLH1 (0.46) KMT2A

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
WO-2023158768-A1 DUAL CATALYST SYSTEM FOR MASS ROMP AND CATIONIC POLYMERIZABLE COMPOSITIONS PROMERUS, LLC (US) 2023-08-24 WO claimed
EP-4288479-A1 LONG SHELF LIFE STABLE PHOTOACTIVE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS AS OPTICAL MATERIALS Promerus, LLC (US) 2023-12-13 EP disclosed
WO-2022169801-A1 LONG SHELF LIFE STABLE PHOTOACTIVE MASS POLYMERIZABLE POLYCYCLOOLEFIN COMPOSITIONS AS OPTICAL MATERIALS PROMERUS, LLC (US) 2022-08-11 WO disclosed