SCHEMBL16599861

SCHEMBL16599861

O=C(C=Cc1ccc(Cl)c(Cl)c1)N1CC2(CCN(C(=O)c3ccc(C(F)(F)F)cc3)CC2)C1

nearest known ligand 0.66

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GPR183 P32249 14/20 0.66
▸ NPC1 O15118 1/20 0.48
▸ RAB9A P51151 1/20 0.48
▸ TDP1 Q9NUW8 1/20 0.48
▸ ENPP2 Q13822 2/20 0.48
▸ ATXN2 Q99700 2/20 0.48
▸ USP2 O75604 1/20 0.46
▸ CYP3A4 P08684 1/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ MRGPRX4 Q96LA9 1/20 0.45

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
SCHEMBL16599859 1.00 GPR183 (0.66) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16599936 0.89 GPR183 (0.73) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16599938 0.89 GPR183 (0.73) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16600409 0.89 GPR183 (0.77) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16600407 0.89 GPR183 (0.77) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16614487 0.89 GPR183 (0.77) GPR183NPC1RAB9ATDP1
SCHEMBL20684457 0.85 GPR183 (0.78) GPR183SMN1; SMN2
SCHEMBL16599931 0.84 GPR183 (0.73) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16599928 0.84 GPR183 (0.73) GPR183NPC1RAB9ATDP1ENPP2
SCHEMBL16600071 0.81 GPR183 (0.78) GPR183SMN1; SMN2

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-10196369-B2 Spirocyclic EBI2 modulators Sanford Burnham Prebys Medical Discovery Institute (US) 2019-02-05 — — US claimed
WO-2015048567-A1 SPIROCYCLIC EBI2 MODULATORS SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) 2015-04-02 — — 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-10196369-B2 Spirocyclic EBI2 modulators HAVCR2, BIRC2, ESR2 GPR183 17/4885NPC1 1288/4885RAB9A 1528/4885

“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.

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