SCHEMBL20149062

SCHEMBL20149062

O=C(Cl)N1CCC(c2cccnc2)C1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 4/20 0.63
SPR P35270 1/20 0.61
NAMPT P43490 1/20 0.52
CYP11B2 P19099 1/20 0.51
ALDH1A1 P00352 4/20 0.46
CHRNA7 P36544 4/20 0.46
CHRNB2 P17787 3/20 0.46
CHRNA4 P43681 3/20 0.46
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
RAB9A P51151 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
POLB P06746 1/20 0.45
SCD O00767 1/20 0.45
SCD5 Q86SK9 1/20 0.45
CHRNB4 P30926 2/20 0.44
CHRNA3 P32297 2/20 0.44
CHRNA2 Q15822 2/20 0.44
LMNA P02545 1/20 0.44
TDP1 Q9NUW8 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
SCHEMBL3928801 0.86 HSD11B1 (0.60) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL14276850 0.86 HSD11B1 (0.60) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL14413519 0.86 HSD11B1 (0.60) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL14008938 0.82 HSD11B1 (0.57) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL14035863 0.82 HSD11B1 (0.57) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL16886321 0.82 HSD11B1 (0.57) HSD11B1SPRNAMPTCYP11B2ALDH1A1
SCHEMBL20149063 0.82 HSD11B1 (0.60) HSD11B1SPRNAMPTALDH1A1NPC1
SCHEMBL17891160 0.82 RAB9A (0.63) HSD11B1SPRALDH1A1NPC1TP53
SCHEMBL20139653 0.82 RAB9A (0.63) HSD11B1SPRALDH1A1NPC1TP53
SCHEMBL5901385 0.81 HSD11B1 (0.57) HSD11B1SPRNAMPTCYP11B2ALDH1A1

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-11078186-B2 ROR γ modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2021-08-03 US disclosed
WO-2018089406-A1 ROR GAMMA MODULATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2018-05-17 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-11078186-B2 ROR γ modulators RORB, RORC, RORA HSD11B1 30/4885SPR 2412/4885NAMPT 1641/4885

“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.