SCHEMBL23657692

SCHEMBL23657692

N#Cc1cnc2c(-c3ccc(Cl)cc3)cnn2c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 12/20 0.59
RXFP1 Q9HBX9 2/20 0.47
KDM4E B2RXH2 2/20 0.47
ALDH1A1 P00352 2/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
FLT1 P17948 2/20 0.46
FLT4 P35916 2/20 0.46
KMT2A Q03164 2/20 0.44
RAB9A P51151 5/20 0.43
NPC1 O15118 4/20 0.43
MEN1 O00255 1/20 0.42
MAPT P10636 3/20 0.40
SMN1; SMN2 Q16637 3/20 0.40
BMP4 P12644 1/20 0.40
TGFBR1 P36897 1/20 0.40
ACVR1 Q04771 1/20 0.40
PRKAB1 Q9Y478 1/20 0.40

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
SCHEMBL25222640 0.77 KDR (0.46) KDRFLT1FLT4BMP4TGFBR1
SCHEMBL7618521 0.75 KDR (0.77) KDRRXFP1FLT1FLT4KMT2A
SCHEMBL7616707 0.74 KDR (1.00) KDRFLT1FLT4RAB9ANPC1
SCHEMBL25423868 0.71 KDR (0.49) KDRFLT1FLT4KMT2ABMP4
SCHEMBL24767177 0.70 KDM4E (0.43) KDM4EALDH1A1LMNA
SCHEMBL17080357 0.70 PRKAB2 (0.47) KDRKDM4EALDH1A1LMNAFLT1
SCHEMBL31470548 0.70 SMPD3 (0.44) KDRKDM4EALDH1A1LMNAKMT2A
SCHEMBL25424497 0.70 KDR (0.47) KDRFLT1FLT4BMP4TGFBR1
SCHEMBL25421584 0.69 CYP11B2 (0.40) KDRFLT1FLT4BMP4
SCHEMBL19110487 0.69 ACVR1 (0.62) KDRFLT1FLT4BMP4TGFBR1

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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE EDIGENE BIOTECHNOLOGY, INC. (CN) 2021-07-22 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-20210220408-A1 ARYL HYDROCARBON RECEPTOR ANTAGONISTS AND METHODS OF USE AHR, ARNT, ARSA KDR 623/4885RXFP1 1438/4885KDM4E 1784/4885

“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.