SCHEMBL4256809

SCHEMBL4256809

c1ccc2ccc(-c3ccc4cccccc3-4)c-2cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.52
HSD17B10 Q99714 3/20 0.52
BCL2L1 Q07817 2/20 0.52
MAPK1 P28482 2/20 0.52
HPGD P15428 1/20 0.52
CYP2A6 P11509 1/20 0.52
PTGS2 P35354 1/20 0.52
MEN1 O00255 1/20 0.52
APAF1 O14727 1/20 0.52
NPC1 O15118 1/20 0.52
LMNA P02545 1/20 0.52
MAPT P10636 1/20 0.52
THRB P10828 1/20 0.52
XBP1 P17861 1/20 0.52
PTBP1 P26599 1/20 0.52
HTT P42858 1/20 0.52
RAB9A P51151 1/20 0.52
GALK1 P51570 1/20 0.52
BLM P54132 1/20 0.52
SMAD3 P84022 1/20 0.52

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
SCHEMBL30862544 1.00 ALDH1A1 (0.52) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL31485753 1.00 ALDH1A1 (0.52) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL6754212 0.97 ALDH1A1 (0.55) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL28184105 0.93 ALDH1A1 (0.60) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL608537 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL29414275 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL29352295 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL30332559 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL192419 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD
SCHEMBL29414264 0.93 ALDH1A1 (0.58) ALDH1A1HSD17B10BCL2L1MAPK1HPGD

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-1765756-B1 OLIGOMERIC DERIVATIVES OF SPIROBIFLUORENE, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2016-12-28 EP claimed
US-8614357-B2 Oligomeric derivatives of spirobifluorene, their preparation and use MERCK PATENT GMBH (DE) 2013-12-24 US claimed
US-20090234164-A1 Oligomeric derivatives of spirobifluorene, their preparation and use MERCK PATENT GMBH (DE) 2009-09-17 US claimed
EP-1765756-B1 OLIGOMERIC DERIVATIVES OF SPIROBIFLUORENE, THEIR PREPARATION AND USE MERCK PATENT GMBH (DE) 2016-12-28 EP disclosed
US-8614357-B2 Oligomeric derivatives of spirobifluorene, their preparation and use MERCK PATENT GMBH (DE) 2013-12-24 US disclosed
US-20090234164-A1 Oligomeric derivatives of spirobifluorene, their preparation and use MERCK PATENT GMBH (DE) 2009-09-17 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090234164-A1 Oligomeric derivatives of spirobifluorene, their preparation and use NR3C2, NR0B2, NR0B1 ALDH1A1 2385/4885HSD17B10 1177/4885BCL2L1 760/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.