SCHEMBL1867247

SCHEMBL1867247

CC1Cc2ccccc2N1C(=O)NCC1CCCCC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.62
CACNA1H O95180 1/20 0.55
NOTUM Q6P988 1/20 0.55
ALDH1A1 P00352 7/20 0.51
MAPT P10636 3/20 0.51
SMN1; SMN2 Q16637 3/20 0.51
POLB P06746 1/20 0.51
LMNA P02545 4/20 0.50
TSHR P16473 2/20 0.50
HPGD P15428 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
NPSR1 Q6W5P4 1/20 0.49
NPC1 O15118 3/20 0.48
RAB9A P51151 3/20 0.48
CYP2C19 P33261 2/20 0.48
CYP1A2 P05177 1/20 0.48
MEN1 O00255 3/20 0.47
KMT2A Q03164 3/20 0.47
CYP3A4 P08684 1/20 0.47

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
SCHEMBL1861699 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL1865415 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL1865417 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL1867501 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL13276088 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL1865452 0.81 LMNA (0.59) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL10859231 0.77 NOTUM (0.69) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL1866260 0.76 PKM (0.71) PKMNOTUMALDH1A1MAPTSMN1; SMN2
SCHEMBL10854008 0.75 PKM (0.90) PKMNOTUMALDH1A1MAPTLMNA
SCHEMBL1861546 0.74 MAPT (0.83) PKMNOTUMALDH1A1MAPTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120263848-A1 Organic Compounds GIVAUDAN SA (CH) 2012-10-18 US claimed
US-20120263848-A1 Organic Compounds GIVAUDAN SA (CH) 2012-10-18 US disclosed
US-20120263848-A1 Organic Compounds GIVAUDAN SA (CH) 2012-10-18 US disclosed
US-20120263848-A1 Organic Compounds GIVAUDAN SA (CH) 2012-10-18 US disclosed
EP-2493853-A1 ORGANIC COMPOUNDS Givaudan SA (CH) 2012-09-05 EP disclosed
WO-2011051394-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2011-05-05 WO disclosed
WO-2011051394-A1 ORGANIC COMPOUNDS GIVAUDAN SA (CH) 2011-05-05 WO 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-20120263848-A1 Organic Compounds OR10J3, CBR3, C9 PKM 1697/4885CACNA1H 4134/4885NOTUM 2186/4885

“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.