SCHEMBL7479415

SCHEMBL7479415

[O]c1c(Sc2ccccc2)ccc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SIRT1 Q96EB6 2/20 0.42
▸ TUBB4A P04350 1/20 0.42
▸ TUBB P07437 1/20 0.42
▸ TUBA3C P0DPH7 1/20 0.42
▸ TUBA1B P68363 1/20 0.42
▸ TUBA4A P68366 1/20 0.42
▸ TUBB4B P68371 1/20 0.42
▸ TUBB3 Q13509 1/20 0.42
▸ TUBB2A Q13885 1/20 0.42
▸ TUBB8 Q3ZCM7 1/20 0.42
▸ TUBA3E Q6PEY2 1/20 0.42
▸ TUBA1A Q71U36 1/20 0.42
▸ TUBA1C Q9BQE3 1/20 0.42
▸ TUBB6 Q9BUF5 1/20 0.42
▸ TUBB2B Q9BVA1 1/20 0.42
▸ TUBB1 Q9H4B7 1/20 0.42
▸ ALDH1A1 P00352 3/20 0.41
▸ TDP1 Q9NUW8 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ CYP2A6 P11509 1/20 0.41

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
SCHEMBL8048298 0.82 IFNAR1 (0.49) SIRT1ALDH1A1TDP1HSD17B10CYP2A6
SCHEMBL30958572 0.82 ALDH1A1 (0.46) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2890325 0.79 IFNAR1 (0.49) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL31490493 0.79 IFNAR1 (0.49) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL11387765 0.77 ADORA2A (0.42) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL5317194 0.77 TUBB4A (0.42) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL31301353 0.77 HPRT1 (0.54) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL202113 0.77 MAPT (0.55) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL3066865 0.77 HSD17B10 (0.52) SIRT1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL2783493 0.77 ERN1 (0.51) SIRT1TUBB4ATUBBTUBA3CTUBA1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0818512-B1 Quinoline derivative and use of same MITSUI CHEMICALS INC (JP) 2002-10-02 — — EP disclosed
US-6407242-B1 REACTING A PHTHALIMIDE COMPOUND WITH A QUINOLINE COMPOUND;ELECTROLUMINESCENCE MITSUI CHEMICALS, INC. (JP) 2002-06-18 — — US disclosed
US-6132640-A ZINC COMPLEXES OF QUINOLINE MITSUI CHEMICALS, INC. (JP) 2000-10-17 — — US disclosed
EP-0818512-A1 Quinoline derivative and use of same MITSUI TOATSU CHEMICALS, Inc. (JP) 1998-01-14 — — EP disclosed
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