SCHEMBL11061449

SCHEMBL11061449

C1=CC2=C3Oc4ccccc4CC3CCC2C=C1

nearest known ligand 0.33

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.33
MEN1 O00255 1/20 0.33
RECQL P46063 1/20 0.33
KMT2A Q03164 1/20 0.33
MAOA P21397 1/20 0.33
MAOB P27338 1/20 0.33
NISCH Q9Y2I1 1/20 0.32

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
SCHEMBL4131749 0.63
SCHEMBL23075562 0.63 NPC1 (0.37) MEN1RECQLKMT2AMAOAMAOB
SCHEMBL5611694 0.61 MAPT (0.34) RECQLKMT2A
SCHEMBL9940905 0.61
SCHEMBL16535401 0.59 CTRB1 (0.55) MEN1KMT2AMAOAMAOB
SCHEMBL16535402 0.59 CTRB1 (0.55) MEN1KMT2AMAOAMAOB
SCHEMBL16536459 0.58 CYP2C9 (0.43) MEN1KMT2AMAOAMAOB
SCHEMBL16536460 0.58 CYP2C9 (0.43) MEN1KMT2AMAOAMAOB
Hydrochloric Acid SCHEMBL10460312 0.56 MAOA (0.54) MAOAMAOB
SCHEMBL1850275 0.56 MAOA (0.43) MAOAMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4452991-A OR BENZO(B)INDENO (2,1-E) PYRANS OR BENZO(C)XANTHENES BATCHELOR JOHN F (GB) 1984-06-05 US claimed
EP-0025599-A1 Benzopyran compounds, useful as chemotherapeutic agents THE WELLCOME FOUNDATION LIMITED (GB) 1981-03-25 EP claimed
EP-0025599-A1 Benzopyran compounds, useful as chemotherapeutic agents THE WELLCOME FOUNDATION LIMITED (GB) 1981-03-25 EP disclosed