Butane

Butane

SCHEMBL7499150

CCCC.CCOC(C)OCC.O=Cc1ccc(C(=O)Nc2ccccc2)o1

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 1/20 0.42
RAB9A P51151 9/20 0.41
MAPT P10636 8/20 0.41
LMNA P02545 7/20 0.41
HPGD P15428 5/20 0.41
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
TRPV1 Q8NER1 1/20 0.41
TSHR P16473 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
ALDH1A1 P00352 6/20 0.40
PTPN1 P18031 1/20 0.40
PTPN11 Q06124 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
MAPK1 P28482 3/20 0.40
SMN1; SMN2 Q16637 6/20 0.40
NPC1 O15118 5/20 0.40

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
SCHEMBL7492014 0.83 RAB9A (0.55) CSF1RRAB9AMAPTLMNAHPGD
SCHEMBL6828818 0.72 KLK7 (0.58) CSF1RRAB9AMAPTLMNAHPGD
SCHEMBL7121858 0.71 ALDH1A1 (0.66) RAB9AMAPTLMNAHPGDMEN1
SCHEMBL7129347 0.70 RAB9A (0.62) RAB9AMAPTLMNAMEN1KMT2A
SCHEMBL9370150 0.69 HTT (0.68) RAB9ALMNAMEN1KMT2AALDH1A1
SCHEMBL18993430 0.69 KLK7 (0.50) CSF1RRAB9AMAPTLMNAHPGD
Aes-103 SCHEMBL14809554 0.68 ALDH1A1 (0.67) RAB9AMAPTLMNAHPGDTSHR
SCHEMBL6829092 0.68 NPC1 (0.52) RAB9AMAPTLMNAHPGDMEN1
SCHEMBL7738687 0.68 LMNA (0.39) RAB9AMAPTLMNAHPGDMEN1
SCHEMBL22289272 0.68 HPGD (0.49) CSF1RRAB9ALMNAHPGDMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0989114-B1 N,N-DISUBSTITUTED AMIC ACID DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-07-24 EP disclosed
EP-0882701-B1 SUBSTITUTED AMIDE DERIVATIVES BANYU PHARMA CO LTD (JP) 2002-07-24 EP disclosed
US-6048894-A FARNESYL-PROTEIN TRANSFERASE INHIBITORS, ANTITUMOR OR ANTICANCER AGENTS BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-04-11 US disclosed
EP-0989114-A1 N,N-DISUBSTITUTED AMIC ACID DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 2000-03-29 EP disclosed
US-5981573-A INHIBIT PROTEIN-FARNESYL TRANSFERASE (PFT) IN VIVO THEREBY SUPPRESSING FUNCTION OF ONCOGENE PROTEIN RAS AND THUS PRESENTING ANTITUMOR ACTIVITIES BANYU PHARMACEUTICAL CO., LTD. (JP) 1999-11-09 US disclosed
EP-0882701-A1 SUBSTITUTED AMIDE DERIVATIVES BANYU PHARMACEUTICAL CO., LTD. (JP) 1998-12-09 EP disclosed