SCHEMBL17916664

SCHEMBL17916664

CC(C)N1c2cc3ccccc3cc2N(C(C)C)C1C

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 3/20 0.35
▸ UGT2B7 P16662 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ BRD4 O60885 3/20 0.34
▸ GRM4 Q14833 1/20 0.33
▸ MYC P01106 1/20 0.33
▸ HTR2A P28223 1/20 0.32
▸ HTR2C P28335 1/20 0.32
▸ HTR2B P41595 1/20 0.32
▸ CYP2A6 P11509 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ ACHE P22303 1/20 0.31
▸ LMNA P02545 1/20 0.31
▸ HSD17B10 Q99714 1/20 0.31
▸ CYP1A2 P05177 1/20 0.30
▸ CDK9 P50750 1/20 0.30
▸ MAPT P10636 1/20 0.30

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
SCHEMBL17916655 0.82 GAA (0.35) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL24613060 0.81 CCKBR (0.34) ACHE
SCHEMBL17916662 0.78 ALDH1A1 (0.57) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL12138823 0.74 UGT2B7 (0.30) UGT2B7
SCHEMBL24613061 0.74 TSHR (0.33) KDM4EALDH1A1GAALMNA
SCHEMBL26275300 0.71 KDM4E (0.59) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL24613008 0.67 OPRM1 (0.36) GAAHTR2AHTR2C
SCHEMBL26248469 0.67 POLB (0.33) KDM4EALDH1A1GAABRD4NPSR1
SCHEMBL16420336 0.66 KDM4E (0.32) KDM4EALDH1A1GAAHPGDALOX12
SCHEMBL22781258 0.66 ALDH1A1 (0.37) KDM4EALDH1A1HPGDTDP1ACHE

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-11801528-B2 Carbene-functionalized composite materials QUEEN'S UNIVERSITY AT KINGSTON (CA) 2023-10-31 — — US disclosed
US-20160199875-A1 Carbene-Functionalized Composite Materials QUEEN'S UNIVERSITY AT KINGSTON (CA) 2016-07-14 — — US disclosed
US-20160199875-A1 Carbene-Functionalized Composite Materials QUEEN'S UNIVERSITY AT KINGSTON (CA) 2016-07-14 — — US disclosed
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