SCHEMBL17740951

SCHEMBL17740951

CC(C(=O)Nc1ccccc1)N1CCN(c2ccnc3ccc(F)cc23)CC1

nearest known ligand 0.57

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 4/20 0.49
IDO1 P14902 6/20 0.45
PIK3CA P42336 1/20 0.45
CYP2C9 P11712 2/20 0.44
CYP3A4 P08684 1/20 0.44
CYP2C8 P10632 1/20 0.44
TDO2 P48775 1/20 0.44
KCNH2 Q12809 1/20 0.44
MAP4K4 O95819 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
SCHEMBL19093132 0.94 IDO1 (0.51) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL23680166 0.91 IDO1 (0.47) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL17729158 0.90 IDO1 (0.46) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL17729130 0.90 IDO1 (0.56) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL22986523 0.90 IDO1 (0.46) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL21213934 0.89 IDO1 (0.57) PDGFRBIDO1PIK3CACYP2C9CYP3A4
Hydrochloric Acid SCHEMBL22730002 0.88 IDO1 (0.56) PDGFRBIDO1PIK3CACYP2C9CYP3A4
SCHEMBL17729240 0.88 PDGFRB (0.47) PDGFRBIDO1PIK3CA
SCHEMBL23699121 0.86 IDO1 (0.44) PDGFRBIDO1CYP2C9CYP3A4CYP2C8
SCHEMBL17729152 0.85 PIK3CA (0.50) PDGFRBIDO1PIK3CA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170197973-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2017-07-13 US claimed
US-9643972-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2017-05-09 US claimed
EP-3854394-A1 IMMUNOREGULATORY AGENTS Flexus Biosciences, Inc. (US) 2021-07-28 EP disclosed
CN-107427499-B Immunomodulator 弗莱塞斯生物科学公司 2021-04-16 CN disclosed
EP-3215153-B1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2020-12-23 EP disclosed
EP-3215153-B1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2020-12-23 EP disclosed
US-20190002472-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2019-01-03 US disclosed
US-20190002472-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2019-01-03 US disclosed
US-10106546-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2018-10-23 US disclosed
US-20180282281-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2018-10-04 US disclosed
US-20170197973-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2017-07-13 US disclosed
US-20170197973-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2017-07-13 US disclosed
US-20170197973-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES INC (US) 2017-07-13 US disclosed
US-9643972-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2017-05-09 US disclosed
US-9643972-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2017-05-09 US disclosed
US-9643972-B2 Immunoregulatory agents FLEXUS BIOSCIENCES, INC. (US) 2017-05-09 US disclosed
US-20160137652-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2016-05-19 US disclosed
US-20160137652-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2016-05-19 US disclosed
US-20160137652-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. 2016-05-19 US disclosed
WO-2016073770-A1 IMMUNOREGULATORY AGENTS FLEXUS BIOSCIENCES, INC. (US) 2016-05-12 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 (5 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-10106546-B2 Immunoregulatory agents IDO1, IDO2, INMT PDGFRB 3932/4885IDO1 1/4885PIK3CA 4170/4885
US-20180282281-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT PDGFRB 3932/4885IDO1 1/4885PIK3CA 4170/4885
US-20160137652-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT PDGFRB 3932/4885IDO1 1/4885PIK3CA 4170/4885
US-20190002472-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT PDGFRB 3932/4885IDO1 1/4885PIK3CA 4170/4885
US-20170197973-A1 IMMUNOREGULATORY AGENTS IDO1, IDO2, INMT PDGFRB 3932/4885IDO1 1/4885PIK3CA 4170/4885

“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.