SCHEMBL8102664

SCHEMBL8102664

CC(=O)N1CCCCC1C(=O)NCCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FKBP1A P62942 10/20 0.64
POLB P06746 1/20 0.61
ATM Q13315 1/20 0.61
MEN1 O00255 1/20 0.61
KMT2A Q03164 1/20 0.61
RAB9A P51151 2/20 0.56
NPSR1 Q6W5P4 2/20 0.56
NPC1 O15118 1/20 0.56
GAA P10253 1/20 0.56
TAAR1 Q96RJ0 2/20 0.55
CYP3A4 P08684 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
TSHR P16473 1/20 0.55
ALDH1A1 P00352 1/20 0.54
MAPK1 P28482 1/20 0.54

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
SCHEMBL8104234 0.96 POLB (0.65) FKBP1APOLBATMMEN1KMT2A
SCHEMBL8096850 0.83 CYP3A4 (0.72) FKBP1APOLBMEN1KMT2ANPC1
SCHEMBL27394992 0.83 CYP3A4 (0.72) FKBP1APOLBMEN1KMT2ANPC1
SCHEMBL23532710 0.82 FKBP1A (0.73) FKBP1APOLB
SCHEMBL23532712 0.82 FKBP1A (0.73) FKBP1APOLB
SCHEMBL8102668 0.82 KMT2A (0.69) POLBATMMEN1KMT2ANPC1
SCHEMBL12733420 0.81 FKBP1A (0.66) FKBP1APOLBATMMEN1KMT2A
SCHEMBL28628871 0.80 MEN1 (0.61) FKBP1APOLBATMMEN1KMT2A
SCHEMBL11096695 0.80 MEN1 (0.61) FKBP1APOLBATMMEN1KMT2A
SCHEMBL4575683 0.79 FKBP1A (0.54) FKBP1APOLBATMMEN1KMT2A

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
US-20130028843-A1 KALLIKREIN 7 MODULATORS NOVARTIS AG (CH) 2013-01-31 US disclosed
US-8309596-B2 Kallikrein 7 modulators NOVARTIS AG (CH) 2012-11-13 US disclosed
US-8309596-B2 Kallikrein 7 modulators NOVARTIS AG (CH) 2012-11-13 US disclosed
US-20100256144-A1 Kallikrein 7 modulators NOVARTIS AG (CH) 2010-10-07 US disclosed
US-20100256144-A1 Kallikrein 7 modulators NOVARTIS AG (CH) 2010-10-07 US disclosed
WO-2009000878-A1 KALLIKREIN 7 MODULATORS NOVARTIS AG (CH) 2008-12-31 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 (2 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-20130028843-A1 KALLIKREIN 7 MODULATORS KLK7, KLK5, KLKB1 FKBP1A 2112/4885POLB 4716/4885ATM 1144/4885
US-20100256144-A1 Kallikrein 7 modulators KLK7, KLK5, KLKB1 FKBP1A 2112/4885POLB 4716/4885ATM 1144/4885

“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.