SCHEMBL4465883

SCHEMBL4465883

CC(=O)N1CCC(OCCCc2ccccc2)CC1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 2/20 0.53
ALDH1A1 P00352 3/20 0.50
KMT2A Q03164 1/20 0.50
NAMPT P43490 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.45
HRH3 Q9Y5N1 1/20 0.44
OPRM1 P35372 1/20 0.44
POLB P06746 2/20 0.44
LMNA P02545 2/20 0.44
MAPK1 P28482 1/20 0.44
USP2 O75604 1/20 0.44
FKBP1A P62942 1/20 0.43
BCHE P06276 1/20 0.43

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
SCHEMBL7932023 0.81 NMT1 (0.52) AGTR2HRH3OPRM1
SCHEMBL27373891 0.79 SLC18A3 (0.56) ALDH1A1KMT2AHRH3
SCHEMBL28015033 0.77 FKBP1A (0.45) AGTR2ALDH1A1KMT2ANAMPTSMN1; SMN2
SCHEMBL11477961 0.77 HRH3 (0.42) ALDH1A1NAMPTHRH3POLB
SCHEMBL22856426 0.76 ALDH1A1 (0.46) ALDH1A1SMN1; SMN2POLBLMNAUSP2
SCHEMBL21535464 0.76 OPRM1 (0.59) AGTR2KMT2AHRH3OPRM1LMNA
SCHEMBL27517665 0.76 OPRM1 (0.55) AGTR2KMT2AHRH3OPRM1
SCHEMBL426875 0.76 FAAH (0.65)
SCHEMBL11999863 0.76 DRD4 (0.64) OPRM1
SCHEMBL16332966 0.76 CARM1 (0.54) ALDH1A1KMT2AHRH3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7494992-B2 Antiparasitic terpene alkaloids PFIZER INC. (US) 2009-02-24 US disclosed
US-20070185101-A1 Antiparasitic terpene alkaloids PFIZER PRODUCTS INC 2007-08-09 US disclosed
EP-1597264-A2 ANTIPARASITIC TERPENE ALKALOIDS Pfizer Limited (GB) 2005-11-23 EP disclosed
WO-2004072086-A2 ANTIPARASITIC TERPENE ALKALOIDS PFIZER LIMITED (GB) 2004-08-26 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-20070185101-A1 Antiparasitic terpene alkaloids CYP51A1, DHPS, CYP8B1 AGTR2 1675/4885ALDH1A1 441/4885KMT2A 940/4885

“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.