SCHEMBL17830819

SCHEMBL17830819

O=C1c2cc(F)ccc2-n2c1nc1cc(I)ccc1c2=O

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 17/20 0.71
TDO2 P48775 17/20 0.71
IDO2 Q6ZQW0 12/20 0.71
APAF1 O14727 2/20 0.71
MEN1 O00255 1/20 0.71
NPC1 O15118 1/20 0.71
MITF O75030 1/20 0.71
HSP90AA1 P07900 1/20 0.71
RAB9A P51151 1/20 0.71
KMT2A Q03164 1/20 0.71

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
SCHEMBL4585634 0.91 IDO1 (0.80) IDO1TDO2IDO2APAF1MEN1
SCHEMBL17830818 0.90 IDO1 (0.83) IDO1TDO2IDO2APAF1MEN1
SCHEMBL26614214 0.86 IDO1 (0.73) IDO1TDO2IDO2APAF1MEN1
SCHEMBL30639074 0.85 IDO1 (0.71) IDO1TDO2IDO2APAF1MEN1
SCHEMBL26614220 0.85 IDO1 (0.71) IDO1TDO2IDO2APAF1MEN1
SCHEMBL9103254 0.83 IDO1 (0.80) IDO1TDO2IDO2APAF1MEN1
SCHEMBL31680506 0.83 TDO2 (1.00) IDO1TDO2IDO2APAF1MEN1
SCHEMBL9115231 0.83 TDO2 (1.00) IDO1TDO2IDO2APAF1MEN1
SCHEMBL9105370 0.83 IDO1 (1.00) IDO1TDO2IDO2APAF1MEN1
SCHEMBL4586093 0.82 APAF1 (0.71) IDO1TDO2IDO2APAF1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9630969-B2 N-alkyl tryptanthrin derivative, preparation method for same, and application thereof SHANGHAI TIN TSZ BIO VALLEY BIOLOGICAL ENGINEERING CO., LTD (CN) 2017-04-25 US disclosed
US-9630969-B2 N-alkyl tryptanthrin derivative, preparation method for same, and application thereof SHANGHAI TIN TSZ BIO VALLEY BIOLOGICAL ENGINEERING CO., LTD (CN) 2017-04-25 US disclosed
US-20160168152-A1 N-ALKYL TRYPTANTHRIN DERIVATIVE, PREPARATION METHOD FOR SAME, AND APPLICATION THEREOF SHANGHAI TIN TSZ BIO VALLEY BIOLOGICAL ENGINEERING CO., LTD (CN) 2016-06-16 US disclosed
US-20160168152-A1 N-ALKYL TRYPTANTHRIN DERIVATIVE, PREPARATION METHOD FOR SAME, AND APPLICATION THEREOF SHANGHAI TIN TSZ BIO VALLEY BIOLOGICAL ENGINEERING CO., LTD (CN) 2016-06-16 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-20160168152-A1 N-ALKYL TRYPTANTHRIN DERIVATIVE, PREPARATION METHOD FOR SAME, AND APPLICATION THEREOF IDO1, IDO2, TPH1 IDO1 1/4885TDO2 9/4885IDO2 2/4885

“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.