SCHEMBL4906885

SCHEMBL4906885

NCC(=O)N1CC=C(c2cc3ccccc3o2)CC1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.58
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
POLB P06746 1/20 0.43
ALDH1A1 P00352 5/20 0.42
HPGD P15428 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
HRH4 Q9H3N8 1/20 0.41
SMN1; SMN2 Q16637 3/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
CNR1 P21554 1/20 0.39
CD74 P04233 1/20 0.39
MIF P14174 1/20 0.39
FLT3 P36888 1/20 0.38
GRIN2B Q13224 1/20 0.38
TSHR P16473 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
GLA P06280 1/20 0.37

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
SCHEMBL10901831 0.81 MAPT (0.53) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL4779256 0.78 MAPT (0.45) MAPTMEN1KMT2AALDH1A1TSHR
SCHEMBL15594939 0.78 PDK4 (0.53) MAPTCNR1
SCHEMBL4774596 0.76 MAPT (0.50) MAPTCNR1
SCHEMBL4778486 0.74 HDAC8 (0.55) MAPT
SCHEMBL10901794 0.74 NPC1 (0.46) MAPTHPGDSMN1; SMN2NPC1RAB9A
SCHEMBL4775621 0.73 MEN1 (0.61) MAPTMEN1KMT2AALDH1A1HPGD
SCHEMBL8324685 0.72 DRD4 (0.61) MAPTGRIN2B
SCHEMBL4771251 0.71 MAPT (0.44) MAPTMEN1KMT2APOLBALDH1A1
SCHEMBL10901687 0.70 MEN1 (0.45) MAPTMEN1KMT2APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 US claimed
US-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof NOVARTIS AG 2008-10-16 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-20080255149-A1 Carboxyamine Compounds and Methods of Use Thereof HNMT, HDAC5, HDAC4 MAPT 1165/4885MEN1 1807/4885KMT2A 41/4885

“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.