SCHEMBL11333334

SCHEMBL11333334

CCCCCCCCCCCCC(Oc1ccc(C(C)(C)CC)cc1)C(=O)Nc1ccc(Cl)c([NH])c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADCY6 O43306 2/20 0.48
ADCY3 O60266 2/20 0.48
ADCY9 O60503 2/20 0.48
ADCY5 O95622 2/20 0.48
ADCY8 P40145 2/20 0.48
GCGR P47871 2/20 0.48
ADCY7 P51828 2/20 0.48
ADCY2 Q08462 2/20 0.48
ADCY1 Q08828 2/20 0.48
ADCY4 Q8NFM4 2/20 0.48
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
HDAC2 Q92769 2/20 0.35
ACACB O00763 1/20 0.35
NPC1 O15118 1/20 0.34
CYP1A2 P05177 1/20 0.34
CYP2C9 P11712 1/20 0.34
HPGD P15428 1/20 0.34
CYP2C19 P33261 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL8683418 0.84 ESRRA (0.45) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL2449481 0.84 ESRRA (0.45) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL8101980 0.84 ESRRA (0.45) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL11367539 0.81 ADCY6 (0.44) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL8421004 0.78 ADCY6 (0.38) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL8856383 0.78 PYGL (0.40) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL11343905 0.77 ADCY6 (0.43) ADCY6ADCY3ADCY9ADCY5ADCY8
SCHEMBL8856087 0.76 KDM4E (0.53) MAPT
SCHEMBL7044353 0.76 MEN1 (0.41) ACACBRAB9ASMN1; SMN2LMNAMAPT
SCHEMBL8683421 0.73 ESRRA (0.45) ADCY6ADCY3ADCY9ADCY5ADCY8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4277398-A ORANGE-COLORED, COUNTERACTING UNWANTED ABSORPTION OF MAGENTA DYES IN COLOR PHOTOGRAPHY CIBA-GEIGY AG (CH) 1981-07-07 US claimed
US-4277398-A ORANGE-COLORED, COUNTERACTING UNWANTED ABSORPTION OF MAGENTA DYES IN COLOR PHOTOGRAPHY CIBA-GEIGY AG (CH) 1981-07-07 US disclosed