SCHEMBL8084978

SCHEMBL8084978

CCCCOC1=C(OCCCC)CC1.O=c1ccc1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
CRBN Q96SW2 1/20 0.41
NPY1R P25929 1/20 0.41
NPY2R P49146 1/20 0.41
NPC1 O15118 1/20 0.39
TSHR P16473 2/20 0.39
CA12 O43570 2/20 0.39
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA7 P43166 2/20 0.39
CA9 Q16790 2/20 0.39
POLB P06746 1/20 0.39
KMT2A Q03164 1/20 0.39
LTA4H P09960 2/20 0.38
CA3 P07451 1/20 0.38
CA4 P22748 1/20 0.38
CA6 P23280 1/20 0.38
CA14 Q9ULX7 1/20 0.38
CA5B Q9Y2D0 1/20 0.38
CYP1A2 P05177 1/20 0.37

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
SCHEMBL3011707 0.87 LTA4H (0.41) NPC1TSHRCA12CA1CA2
SCHEMBL16158023 0.76 GAA (0.39) LMNACRBNNPY1RNPY2RNPC1
SCHEMBL18826201 0.75 LMNA (0.38) LMNACRBNNPY1RNPY2RNPC1
SCHEMBL27488484 0.72 ALDH1A1 (0.36) LMNAPOLB
SCHEMBL27514767 0.71 GAA (0.38) LMNANPC1TSHRKMT2ALTA4H
SCHEMBL18826202 0.70 PTGS1 (0.43) LMNANPY1RNPY2RTSHR
SCHEMBL18826165 0.70 CYP1A2 (0.35) LMNACRBNNPY1RNPY2RTSHR
SCHEMBL4389326 0.67 TSHR (0.33) LMNACRBNNPY1RNPY2RNPC1
SCHEMBL11396088 0.67 TSHR (0.50) LMNATSHRCA12CA1CA2
SCHEMBL11121933 0.67 TSHR (0.42) NPC1TSHRPOLBKMT2ALTA4H

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-0743574-B1 Migration imaging members XEROX CORP (US) 2000-12-27 EP claimed
EP-0743573-B1 Method for obtaining image contrast migration imaging members XEROX CORP (US) 2000-09-06 EP claimed