SCHEMBL10889346

SCHEMBL10889346

CCC1(CC)OC1(CC)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.36
MEN1 O00255 2/20 0.36
POLB P06746 2/20 0.36
KMT2A Q03164 2/20 0.36
CYP1A2 P05177 1/20 0.36
APEX1 P27695 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
HCAR3 P49019 1/20 0.35
HCAR2 Q8TDS4 1/20 0.35
CYP2C19 P33261 2/20 0.34
LMNA P02545 3/20 0.33
TP53 P04637 1/20 0.33
OPRM1 P35372 1/20 0.32
OPRK1 P41145 1/20 0.32
OPRL1 P41146 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
THRB P10828 1/20 0.32

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
SCHEMBL19809196 0.80 TSHR (0.35) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL19809193 0.74 TSHR (0.37) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL9817499 0.72 HCAR3 (0.40) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL3417166 0.71 CYP2D6 (0.40) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL19809360 0.68 KDM1A (0.33) MEN1KMT2ATDP1CYP2C19LMNA
SCHEMBL20543240 0.68 LMNA (0.36) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL19809282 0.68 MMP2 (0.37) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL7550872 0.68 TSHR (0.40) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL19809338 0.68 MEN1 (0.36) TSHRMEN1POLBKMT2ACYP1A2
SCHEMBL9692240 0.68 MEN1 (0.43) TSHRMEN1KMT2AHCAR3HCAR2

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-20140087136-A1 RESIN COMPOSITION AND SEMICONDUCTOR DEVICE BOARD ZEON CORPORATION (JP) 2014-03-27 US disclosed
US-4603171-A ANTIONIC CATALYSTS PHILLIPS PETROLEUM COMPANY (US) 1986-07-29 US disclosed
US-3975279-A B-(HALOPROPYL)-THIONOPHOSPHATE AND A STYRENE OXIDE ETHYL CORPORATION (US) 1976-08-17 US disclosed