SCHEMBL20838698

SCHEMBL20838698

O=C(CC1CCC(c2ccccc2)CC1)Nc1ccc(-c2ccccc2)cc1

nearest known ligand 0.78

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.78
EPHX2 P34913 1/20 0.58
NAMPT P43490 2/20 0.53
NPC1 O15118 3/20 0.51
RAB9A P51151 3/20 0.51
MITF O75030 1/20 0.51
ALDH1A1 P00352 1/20 0.51
HTT P42858 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
KMT2A Q03164 1/20 0.51
DGAT1 O75907 12/20 0.51
SOAT2 O75908 1/20 0.50
SOAT1 P35610 1/20 0.48

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
SCHEMBL17737261 1.00 IDO1 (0.78) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL17737013 1.00 IDO1 (0.78) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL20838748 0.91 IDO1 (0.82) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL17737334 0.91 IDO1 (0.82) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL17731110 0.89 IDO1 (0.78) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL20838710 0.88 EPHX2 (0.62) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL17731111 0.88 EPHX2 (0.62) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL20838648 0.88 IDO1 (1.00) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL20838713 0.88 IDO1 (0.76) IDO1EPHX2NAMPTNPC1RAB9A
SCHEMBL20838647 0.88 IDO1 (1.00) IDO1EPHX2NAMPTNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11932601-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2024-03-19 US claimed
US-20220274926-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2022-09-01 US claimed
US-11932601-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2024-03-19 US disclosed
US-20220274926-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2022-09-01 US disclosed
US-11242319-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2022-02-08 US disclosed
US-11242319-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2022-02-08 US disclosed
US-20190092729-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2019-03-28 US disclosed
US-20190092729-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2019-03-28 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 (4 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-11242319-B2 Immunoregulatory agents IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885NAMPT 457/4885
US-20190092729-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885NAMPT 457/4885
US-11932601-B2 Immunoregulatory agents IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885NAMPT 457/4885
US-20220274926-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885NAMPT 457/4885

“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.