SCHEMBL2111898

SCHEMBL2111898

N#Cc1cccc(-c2cc(Cl)ccc2O)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.56
P2RX1 P51575 1/20 0.53
TMPRSS4 Q9NRS4 1/20 0.47
XDH P47989 1/20 0.47
SLC22A12 Q96S37 1/20 0.47
CLK4 Q9HAZ1 1/20 0.44
RXFP1 Q9HBX9 2/20 0.43
TP53 P04637 1/20 0.43
MAPT P10636 3/20 0.43
MEN1 O00255 2/20 0.43
LMNA P02545 2/20 0.43
KMT2A Q03164 2/20 0.43
HTT P42858 1/20 0.43
ADRA2C P18825 1/20 0.43
CNR1 P21554 1/20 0.42
CNR2 P34972 1/20 0.42
ALOX5 P09917 1/20 0.42
BIRC5 O15392 1/20 0.42
HSD17B3 P37058 1/20 0.42
HPGD P15428 1/20 0.41

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
SCHEMBL5093159 0.87 ALOX5 (0.50) PTGDR2P2RX1TMPRSS4XDHSLC22A12
SCHEMBL22115305 0.82 PTGDR2 (0.54) PTGDR2P2RX1CLK4MAPTMEN1
SCHEMBL5094107 0.81 ALOX5 (0.62) P2RX1RXFP1TP53MAPTMEN1
SCHEMBL4977019 0.81 PIM1 (0.47) XDHSLC22A12CLK4TP53MAPT
SCHEMBL16574038 0.81 PTGDR2 (0.53) PTGDR2P2RX1CLK4MAPTMEN1
SCHEMBL6572418 0.81 ADRA2C (0.50) XDHSLC22A12CLK4ADRA2CCNR1
SCHEMBL9469214 0.80 ADRA2C (0.55) XDHSLC22A12CLK4ADRA2CCNR1
Hydrochloric Acid SCHEMBL6781702 0.79 ADRA2C (0.49) XDHSLC22A12CLK4ADRA2CCNR1
SCHEMBL29588586 0.78 XDH (0.44) PTGDR2P2RX1XDHSLC22A12CLK4
SCHEMBL18618148 0.78 XDH (0.44) PTGDR2P2RX1XDHSLC22A12CLK4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230061841-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2023-03-02 US disclosed
US-11091451-B2 SHMT inhibitors and uses thereof RAZE THERAPEUTICS, INC. (US) 2021-08-17 US disclosed
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. 2019-11-14 US disclosed
WO-2018106636-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2018-06-14 WO disclosed
WO-2018106636-A1 SHMT INHIBITORS AND USES THEREOF RAZE THERAPEUTICS, INC. (US) 2018-06-14 WO disclosed
EP-1611091-B1 Substituted phenylalkanoic acid derivatives and their use for respiratory disease treatment ASTRAZENECA AB (SE) 2014-10-29 EP disclosed
US-8158820-B2 Compounds ASTRAZENECA AB (SE) 2012-04-17 US disclosed
US-20110166117-A1 Novel Compounds ASTRAZENECA AB (SE) 2011-07-07 US disclosed
US-20060264435-A1 Novel compounds ASTRAZENECA AB (SE) 2006-11-23 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 (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-11091451-B2 SHMT inhibitors and uses thereof SHMT1, SHMT2, BHMT PTGDR2 4109/4885P2RX1 4698/4885TMPRSS4 1770/4885
US-20230061841-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT PTGDR2 4109/4885P2RX1 4698/4885TMPRSS4 1770/4885
US-20110166117-A1 Novel Compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 PTGDR2 438/4885P2RX1 171/4885TMPRSS4 2032/4885
US-20060264435-A1 Novel compounds ADRA2C, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HCAR2 PTGDR2 438/4885P2RX1 171/4885TMPRSS4 2032/4885
US-20190345119-A1 SHMT INHIBITORS AND USES THEREOF SHMT1, SHMT2, BHMT PTGDR2 4109/4885P2RX1 4698/4885TMPRSS4 1770/4885

“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.