SCHEMBL9109564

SCHEMBL9109564

CCC1/C=C(\C)CC(C)CC(OC)C2OC(O)(C(=O)C(=O)N3CCCCC3C(=O)OC(C(C)=CC3CCC(OCC=Cc4ccc(Cl)cc4)C(OC)C3)C(C)C(O)CC1=O)C(C)CC2OC

nearest known ligand 0.92

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 18/20 0.92
MEN1 O00255 1/20 0.79
LMNA P02545 1/20 0.79
MAPT P10636 1/20 0.79
KMT2A Q03164 1/20 0.79
THRB P10828 1/20 0.79
FKBP4 Q02790 1/20 0.79
ABCB11 O95342 1/20 0.79
ADORA3 P0DMS8 1/20 0.79
PPP3CA Q08209 2/20 0.77

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
SCHEMBL9110216 0.96 FKBP1A (1.00) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9108254 0.95 FKBP1A (1.00) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9111318 0.95 FKBP1A (0.91) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9110591 0.95 FKBP1A (0.91) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9112930 0.95 FKBP1A (1.00) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9109103 0.93 FKBP1A (0.95) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9111782 0.93 FKBP1A (0.88) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9111993 0.93 FKBP1A (0.95) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9111683 0.93 FKBP1A (0.91) FKBP1AMEN1LMNAMAPTKMT2A
SCHEMBL9111172 0.92 FKBP1A (0.86) FKBP1AMEN1LMNAMAPTKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0619799-A4 METHOD OF MAKING MICROPOROUS NON-ZEOLITIC MOLECULAR SIEVES. CHEVRON RES & TECH (US) 1995-07-05 EP disclosed
WO-1995009857-A1 O-ARYL, O-ALKYL, O-ALKENYL AND O-ALKYNYL-MACROLIDES HAVING IMMUNOSUPPRESSIVE ACTIVITY MERCK & CO., INC. (US) 1995-04-13 WO disclosed
EP-0619799-A1 METHOD OF MAKING MICROPOROUS NON-ZEOLITIC MOLECULAR SIEVES CHEVRON U.S.A. INC. (US) 1994-10-19 EP disclosed
WO-1994010086-A1 METHOD OF MAKING MICROPOROUS NON-ZEOLITIC MOLECULAR SIEVES CHEVRON RESEARCH AND TECHNOLOGY COMPANY, A DIVISONOF CHEVRON U.S.A. INC. (US) 1994-05-11 WO disclosed
EP-0515071-A2 O-aryl, O-alkyl, O-alkenyl and O-alkynylmacrolides having immunosuppressive activity MERCK & CO. INC. (US) 1992-11-25 EP disclosed