SCHEMBL11869833

SCHEMBL11869833

CCC1=C(C2CCCCC2)C(=O)OC1=O

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ ADCY1 Q08828 1/20 0.33
▸ KMT2A Q03164 1/20 0.31
▸ NPC1 O15118 1/20 0.30
▸ RAB9A P51151 1/20 0.30
▸ EPHX2 P34913 1/20 0.30
▸ JAK2 O60674 1/20 0.30
▸ JAK1 P23458 1/20 0.30
▸ JAK3 P52333 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
SCHEMBL306205 0.98 ADCY1 (0.31) ADCY1
SCHEMBL6238652 0.80 KMT2A (0.36) KMT2A
SCHEMBL304318 0.77 CEL (0.33) KMT2A
SCHEMBL10679447 0.75 KMT2A (0.34) KMT2A
SCHEMBL304454 0.73 ALDH1A1 (0.38) KMT2A
SCHEMBL14620427 0.71 CEL (0.33) KMT2A
SCHEMBL20298395 0.71 CEL (0.38) KMT2A
SCHEMBL2647824 0.71 TSHR (0.31) —
SCHEMBL304105 0.70 PTPN1 (0.34) KMT2A
SCHEMBL10349901 0.70 EPHX2 (0.33) EPHX2JAK2JAK1JAK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3960937-A REACTION PRODUCT OF PETROLEUM SULFONIC ACIDS, POLYAMINES, CYCLIC ANHYDRIDES PHILLIPS PETROLEUM COMPANY (US) 1976-06-01 — — US disclosed
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