SCHEMBL17440475

SCHEMBL17440475

O=C(O)CCCCCCCCCCCCCCCCCC1CCNCC1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 5/20 0.67
ITGA2B P08514 5/20 0.67
KDM5A P29375 4/20 0.51
PHF8 Q9UPP1 4/20 0.51
KDM2A Q9Y2K7 4/20 0.51
KDM4C Q9H3R0 3/20 0.51
KDM7A Q6ZMT4 1/20 0.51
GNAI3 P08754 1/20 0.48
GNAO1 P09471 1/20 0.48
GNAI1 P63096 1/20 0.48
KDM4A O75164 1/20 0.47
LMNA P02545 2/20 0.46
TSHR P16473 2/20 0.46
PMP22 Q01453 2/20 0.46
NFKB1 P19838 1/20 0.46
SLC6A1 P30531 2/20 0.46
GABRA5 P31644 2/20 0.46
GABRB2 P47870 2/20 0.46
SLC6A12 P48065 2/20 0.46
SLC6A11 P48066 2/20 0.46

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
Hydrochloric Acid SCHEMBL29119874 0.98 ITGB3 (0.65) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL5751261 0.98 ITGB3 (0.69) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL23909396 0.93 ITGB3 (0.60) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL381083 0.92 ITGB3 (0.66) ITGB3ITGA2BKDM5APHF8KDM2A
Hydrochloric Acid SCHEMBL1532653 0.90 ITGB3 (0.64) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL11844776 0.89 SLC6A1 (0.56) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL26547233 0.87 SLC6A1 (0.58) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL4016447 0.86 ITGB3 (0.55) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL4449247 0.86 KDM5A (0.65) ITGB3ITGA2BKDM5APHF8KDM2A
SCHEMBL826408 0.86 KDM5A (0.65) ITGB3ITGA2BKDM5APHF8KDM2A

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
EP-3169535-A1 PROCESS AND COMPOSITION FOR WELL-DISPERSED, HIGHLY LOADED COLOR MASTERBATCH Carolina Color Corporation (US) 2017-05-24 EP disclosed
WO-2016010815-A1 PROCESS AND COMPOSITION FOR WELL-DISPERSED, HIGHLY LOADED COLOR MASTERBATCH CAROLINA COLOR CORPORATION (US) 2016-01-21 WO disclosed