SCHEMBL20340418

SCHEMBL20340418

NC(=O)C1(Nc2cccc(Cl)c2)CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FAAH O00519 1/20 0.50
TRPV1 Q8NER1 1/20 0.50
LMNA P02545 5/20 0.48
ALDH1A1 P00352 6/20 0.46
MEN1 O00255 5/20 0.46
KMT2A Q03164 5/20 0.46
MAPT P10636 5/20 0.46
HTT P42858 2/20 0.46
HTR2B P41595 1/20 0.46
HTR3E A5X5Y0 1/20 0.46
HTR3B O95264 1/20 0.46
HTR3A P46098 1/20 0.46
HTR3D Q70Z44 1/20 0.46
HTR3C Q8WXA8 1/20 0.46
EPHX2 P34913 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
EPHX1 P07099 2/20 0.45
TSHR P16473 1/20 0.45
RECQL P46063 1/20 0.44

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
SCHEMBL2542108 0.81 CYP1A2 (0.50) FAAHTRPV1ALDH1A1POLB
SCHEMBL1531618 0.79 CYP1A2 (0.51) FAAHLMNAALDH1A1MAPTEPHX2
SCHEMBL17140997 0.76 JAK2 (0.48) LMNAMEN1KMT2A
SCHEMBL29807002 0.75 MAOA (0.38) LMNAALDH1A1MEN1KMT2AMAPT
SCHEMBL29808007 0.75 MAOA (0.38) FAAHTRPV1LMNAALDH1A1MEN1
SCHEMBL193633 0.73 FPR2 (0.48) LMNAALDH1A1MEN1KMT2AHTT
SCHEMBL12315513 0.73 SMN1; SMN2 (0.47) LMNAMEN1KMT2AMAPTNPC1
SCHEMBL8660785 0.73 MEN1 (0.47) FAAHTRPV1LMNAALDH1A1MEN1
SCHEMBL29127890 0.72 RAB9A (0.49) FAAHTRPV1LMNAALDH1A1MEN1
SCHEMBL30667093 0.72 RAB9A (0.49) FAAHTRPV1LMNAALDH1A1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10011601-B2 Substituted spirocyclic inhibitors of autotaxin X-RX, INC. (US) 2018-07-03 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-10011601-B2 Substituted spirocyclic inhibitors of autotaxin ENPP2, SLC10A1, CXCR3 FAAH 1536/4885TRPV1 297/4885LMNA 3178/4885

“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.