SCHEMBL17318325

SCHEMBL17318325

COc1ccc(NC(=O)CC2CCC(c3ccccc3)CC2)cc1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.71
EPHX2 P34913 2/20 0.68
GRIN2B Q13224 1/20 0.56
RAB9A P51151 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
ALDH1A1 P00352 2/20 0.54
MAPT P10636 2/20 0.54
KMT2A Q03164 3/20 0.51
NPC1 O15118 2/20 0.51
CYP3A4 P08684 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
MEN1 O00255 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2D6 P10635 1/20 0.51
NAMPT P43490 2/20 0.50
GPR183 P32249 1/20 0.50
TP53 P04637 2/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
KLK7 P49862 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
SCHEMBL17730903 1.00 IDO1 (0.71) IDO1EPHX2GRIN2BRAB9ASMN1; SMN2
SCHEMBL17737051 0.94 EPHX2 (0.73) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL20838672 0.94 EPHX2 (0.73) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17737372 0.94 EPHX2 (0.73) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL20838710 0.93 EPHX2 (0.62) IDO1EPHX2GRIN2BRAB9ASMN1; SMN2
SCHEMBL17731111 0.93 EPHX2 (0.62) IDO1EPHX2GRIN2BRAB9ASMN1; SMN2
SCHEMBL20838628 0.88 EPHX2 (0.65) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17737052 0.88 EPHX2 (0.65) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17737285 0.88 EPHX2 (0.65) IDO1EPHX2RAB9ASMN1; SMN2ALDH1A1
SCHEMBL17730049 0.88 IDO1 (0.72) IDO1EPHX2ALDH1A1MAPTKMT2A

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 15 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-10987322-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2021-04-27 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
CN-107205970-A Immunomodulator 弗莱塞斯生物科学公司 2017-09-26 CN disclosed
EP-3215141-A2 IMMUNOREGULATORY AGENTS Flexus Biosciences, Inc. (US) 2017-09-13 EP disclosed
US-20170112785-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2017-04-27 US disclosed
EP-3151820-A1 IMMUNOREGULATORY AGENTS Flexus Biosciences, Inc. (US) 2017-04-12 EP disclosed
WO-2016073738-A2 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. (US) 2016-05-12 WO disclosed
WO-2015188085-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. (US) 2015-12-10 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 (6 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 611/4885GRIN2B 2857/4885
US-20190092729-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885GRIN2B 2857/4885
US-20170112785-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885GRIN2B 2857/4885
US-11932601-B2 Immunoregulatory agents IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885GRIN2B 2857/4885
US-20220274926-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885GRIN2B 2857/4885
US-10987322-B2 Immunoregulatory agents IDO1, IDO2, INMT IDO1 1/4885EPHX2 611/4885GRIN2B 2857/4885

“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.