SCHEMBL2807714

SCHEMBL2807714

O=C(O)N1CCC(c2ccncc2)C1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 2/20 0.58
SPR P35270 1/20 0.55
RAB9A P51151 8/20 0.50
NPC1 O15118 6/20 0.50
SMN1; SMN2 Q16637 5/20 0.50
MAPT P10636 3/20 0.50
TP53 P04637 3/20 0.50
ALDH1A1 P00352 2/20 0.50
POLB P06746 1/20 0.50
LMNA P02545 4/20 0.49
NAMPT P43490 1/20 0.48
ATM Q13315 1/20 0.48
HPGD P15428 1/20 0.48
CYP2C9 P11712 1/20 0.47
EPHX2 P34913 1/20 0.47
CYP2J2 P51589 1/20 0.47
SCD5 Q86SK9 2/20 0.46
SCD O00767 1/20 0.46
TSHR P16473 1/20 0.45
NFKB1 P19838 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
SCHEMBL1856770 0.90 LMNA (0.55) HSD11B1SPRRAB9ANPC1TP53
SCHEMBL2720172 0.86 SCD5 (0.49) HSD11B1SPRNPC1MAPTALDH1A1
SCHEMBL14413518 0.85 HSD11B1 (0.56) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL20149063 0.85 HSD11B1 (0.60) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL14276847 0.85 HSD11B1 (0.56) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL16600285 0.85 HSD11B1 (0.56) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL3183827 0.84 RAB9A (0.67) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL3184817 0.84 RAB9A (0.67) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL3183837 0.84 RAB9A (0.67) HSD11B1SPRRAB9ANPC1SMN1; SMN2
SCHEMBL16565829 0.83 RAB9A (0.67) HSD11B1SPRRAB9ANPC1SMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100240638-A1 Organic Compounds and their uses NOVARTIS AG (CH) 2010-09-23 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-20100240638-A1 Organic Compounds and their uses OAT, HAVCR2, CYP3A43 HSD11B1 269/4885SPR 1305/4885RAB9A 3989/4885

“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.