SCHEMBL11244590

SCHEMBL11244590

CCOC(=O)C1C2CCC(CC2)C1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPM1B O75688 2/20 0.62
PTPN1 P18031 2/20 0.62
PPP1CC P36873 2/20 0.62
ALDH1A1 P00352 8/20 0.46
MAPT P10636 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
PKM P14618 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38

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
SCHEMBL19323685 0.92 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL19318639 0.92 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL11241112 0.92 PPM1B (0.59) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL14874442 0.91 PPM1B (0.55) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL14189737 0.91 PPM1B (0.55) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL14874553 0.91 PPM1B (0.55) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL6410025 0.83 PPM1B (0.49) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL10050521 0.83 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL14189734 0.83 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MAPT
SCHEMBL14189733 0.83 PPM1B (0.52) PPM1BPTPN1PPP1CCALDH1A1MAPT

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-4349552-A TREATMENT OF CANCER FUJISAWA PHARMACEUTICAL COMPANY, LTD. (JP) 1982-09-14 US disclosed
EP-0010941-B1 5-FLUOROURACIL DERIVATIVES, PREPARATION THEREOF AND THEIR PHARMACEUTICAL COMPOSITIONS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1982-05-12 EP disclosed
EP-0010941-A1 5-Fluorouracil derivatives, preparation thereof and their pharmaceutical compositions FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1980-05-14 EP disclosed