SCHEMBL18153428

SCHEMBL18153428

N#Cc1c(N)nc2c(F)c(Br)c(Cl)cc2c1O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPK14 Q16539 1/20 0.36
▸ KHK P50053 1/20 0.33
▸ IL4 P05112 1/20 0.33
▸ ADORA1 P30542 6/20 0.33
▸ ADORA2A P29274 5/20 0.33
▸ PIM1 P11309 2/20 0.32
▸ ALDH1A1 P00352 4/20 0.32
▸ KDM4E B2RXH2 4/20 0.32
▸ HPGD P15428 2/20 0.32
▸ MEN1 O00255 2/20 0.32
▸ KMT2A Q03164 2/20 0.32
▸ MAPT P10636 1/20 0.32
▸ PPARG P37231 1/20 0.32
▸ STAT3 P40763 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ RXFP1 Q9HBX9 1/20 0.32
▸ NR2E3 Q9Y5X4 1/20 0.32
▸ NCOR2 Q9Y618 1/20 0.32
▸ GSK3A P49840 1/20 0.31
▸ GSK3B P49841 1/20 0.31

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
SCHEMBL18128716 0.86 KDM4E (0.31) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL29876162 0.86 KDM4E (0.31) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL18153433 0.86 MAPK14 (0.37) MAPK14KHKADORA1ADORA2AALDH1A1
SCHEMBL19104274 0.85 KDM4E (0.30) ALDH1A1KDM4EMEN1KMT2AMAPT
SCHEMBL25250436 0.77 KDM4E (0.36) IL4ADORA1ADORA2APIM1ALDH1A1
SCHEMBL18128520 0.75 ALDH1A1 (0.31) KHKALDH1A1HPGDKMT2AL3MBTL1
SCHEMBL29654262 0.75 ALDH1A1 (0.31) KHKALDH1A1HPGDKMT2AL3MBTL1
SCHEMBL18153473 0.75 KRAS (0.39) KDM4EMAPTL3MBTL1
SCHEMBL20571102 0.73 MAP3K8 (0.34) MAPK14CLK4
SCHEMBL22029169 0.71 — —

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
EP-3283462-B1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC (US) 2020-12-02 — — EP disclosed
EP-3283462-B1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC (US) 2020-12-02 — — EP disclosed
US-10428064-B2 Fused-tricyclic inhibitors of KRAS and methods of use thereof ARAXES PHARMA LLC (US) 2019-10-01 — — US disclosed
US-20180086753-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2018-03-29 — — US disclosed
US-20180086753-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC 2018-03-29 — — US disclosed
EP-3283462-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF Araxes Pharma LLC (US) 2018-02-21 — — EP disclosed
WO-2016168540-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC (US) 2016-10-20 — — WO disclosed
WO-2016168540-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF ARAXES PHARMA LLC (US) 2016-10-20 — — 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 (2 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-10428064-B2 Fused-tricyclic inhibitors of KRAS and methods of use thereof KRAS, NRAS, HRAS MAPK14 1148/4885KHK 3927/4885IL4 3870/4885
US-20180086753-A1 FUSED-TRICYCLIC INHIBITORS OF KRAS AND METHODS OF USE THEREOF KRAS, NRAS, HRAS MAPK14 1148/4885KHK 3927/4885IL4 3870/4885

“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.

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