SCHEMBL3266513

SCHEMBL3266513

CCCC(CCC)(C(=O)c1ccccc1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 3/20 0.50
▸ CES1 P23141 7/20 0.49
▸ CES2 O00748 5/20 0.44
▸ LMNA P02545 2/20 0.42
▸ NAAA Q02083 1/20 0.41
▸ TSHR P16473 2/20 0.41
▸ SRC P12931 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ PTPRC P08575 1/20 0.40
▸ HDAC1 Q13547 1/20 0.40
▸ DRD2 P14416 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ DRD3 P35462 1/20 0.40
▸ KIF11 P52732 1/20 0.40
▸ CYP1A2 P05177 1/20 0.40
▸ CYP3A4 P08684 1/20 0.40
▸ CYP2D6 P10635 1/20 0.40
▸ CYP2C9 P11712 1/20 0.40
▸ NFKB1 P19838 1/20 0.40
▸ CYP2C19 P33261 1/20 0.40

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
SCHEMBL12816020 0.85 CES1 (0.52) PTPN1CES1CES2TSHRSRC
SCHEMBL4002970 0.82 TSHR (0.53) CES1CES2LMNATSHRALDH1A1
SCHEMBL11536474 0.81 NR4A2 (0.47) PTPN1CES1LMNATSHRALDH1A1
SCHEMBL452703 0.81 CES1 (0.49) CES1CES2LMNATSHRSRC
SCHEMBL4006883 0.79 TSHR (0.42) CES1CES2LMNATSHRALDH1A1
SCHEMBL1076574 0.79 TSHR (0.50) LMNATSHRALDH1A1HDAC1DRD2
SCHEMBL28150792 0.79 HTT (0.56) LMNATSHRALDH1A1DRD2OPRM1
SCHEMBL4929013 0.79 CES1 (0.46) CES1CES2LMNANAAASRC
SCHEMBL28879634 0.79 PTPN1 (0.50) PTPN1CES1CES2TSHRSRC
SCHEMBL6761557 0.78 TSHR (0.49) LMNATSHRALDH1A1HDAC1DRD2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1711542-B1 DIRECTLY PHOTODEFINABLE POLYMER COMPOSITIONS AND METHODS THEREOF PROMERUS LLC (US) 2010-06-09 — — EP disclosed
US-7378456-B2 Directly photodefinable polymer compositions and methods thereof PROMERUS LLC (US) 2008-05-27 — — US disclosed
EP-1711542-A2 DIRECTLY PHOTODEFINABLE POLYMER COMPOSITIONS AND METHODS THEREOF Promerus, LLC (US) 2006-10-18 — — EP disclosed
US-20050186502-A1 Directly photodefinable polymer compositions and methods thereof SUMITOMO BAKELITE CO., LTD. (JP) 2005-08-25 — — US disclosed
WO-2005076076-A2 DIRECTLY PHOTODEFINABLE POLYMER COMPOSITIONS AND METHODS THEREOF PROMERUS, LLC (US) 2005-08-18 — — WO disclosed
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