SCHEMBL22220784

SCHEMBL22220784

CN(CC1CCN(C(=O)C2CC2)C1)C(=O)c1ccc(-c2ccccc2)cc1O

nearest known ligand 0.59

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
FASN P49327 15/20 0.59
TACR2 P21452 1/20 0.40
TACR1 P25103 1/20 0.40
TAC3 Q9UHF0 1/20 0.40
BCHE P06276 1/20 0.40
HNF4A P41235 1/20 0.40
ACMSD Q8TDX5 1/20 0.40
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
KMT2A Q03164 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
HDAC1 Q13547 1/20 0.39

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
SCHEMBL22220787 0.87 FASN (0.56) FASNTACR2TACR1TAC3HPGD
SCHEMBL14731379 0.85 FASN (0.52) FASNTACR2TACR1TAC3MEN1
SCHEMBL22220786 0.81 FASN (0.58) FASN
SCHEMBL22220858 0.80 FASN (0.56) FASNTACR2TACR1TAC3BCHE
SCHEMBL14731385 0.79 FASN (0.56) FASN
SCHEMBL22220782 0.79 FASN (0.70) FASNMEN1KMT2A
SCHEMBL14731380 0.78 FASN (0.69) FASN
SCHEMBL22220818 0.77 FASN (0.57) FASN
SCHEMBL22220857 0.76 FASN (0.71) FASN
SCHEMBL22220822 0.75 FASN (0.59) FASN

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
WO-2020150423-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS YUMANITY THERAPEUTICS, INC. (US) 2020-07-23 WO disclosed
US-20200222400-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS JANSSEN PHARMACEUTICA NV (BE) 2020-07-16 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-20200222400-A1 METHODS FOR THE TREATMENT OF NEUROLOGICAL DISORDERS NLN, CLN6, OTC FASN 2790/4885TACR2 1620/4885TACR1 1585/4885

“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.