SCHEMBL11154366

SCHEMBL11154366

C=CCCCC(=O)CCC1(C)C(=O)CCC1=O

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 3/20 0.33
FAAH O00519 3/20 0.33
MAPT P10636 2/20 0.33
ABCC4 O15439 1/20 0.33
LMNA P02545 1/20 0.33
MGLL Q99685 1/20 0.33
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL11152788 0.94 MEN1 (0.34) MEN1KMT2AALDH1A1FAAHMAPT
SCHEMBL16842402 0.76 HSD17B10 (0.35) ALDH1A1MAPTLMNAKDM4EPOLB
SCHEMBL11475333 0.74 TDP1 (0.35) ALDH1A1MAPTKDM4EPOLBTSHR
SCHEMBL4441350 0.73 MAPT (0.54) ALDH1A1FAAHMAPTABCC4LMNA
SCHEMBL9268587 0.71
SCHEMBL9974498 0.70 KDM4E (0.34) MEN1KMT2AALDH1A1MAPTKDM4E
SCHEMBL2541730 0.70 ALDH1A1 (0.38) ALDH1A1MAPTLMNAKDM4EPOLB
SCHEMBL515561 0.68 TSHR (0.50) KMT2AALDH1A1FAAHMAPTABCC4
SCHEMBL515402 0.68 TSHR (0.56) KMT2AALDH1A1FAAHMAPTABCC4
SCHEMBL11857611 0.67 HDAC1 (0.45) MAPTPOLBTSHR

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
EP-0008952-B1 STEROID INTERMEDIATE, METHOD FOR PRODUCTION THEREOF AND METHOD OF PRODUCING ANOTHER STEROID INTERMEDIATE THEREFROM Takeda Chemical Industries, Ltd. (JP) 1983-04-13 EP disclosed
US-4267377-A Intermediates for steroid synthesis TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1981-05-12 US disclosed
EP-0008952-A2 Steroid intermediate, method for production thereof and method of producing another steroid intermediate therefrom Takeda Chemical Industries, Ltd. (JP) 1980-03-19 EP disclosed