SCHEMBL21990156

SCHEMBL21990156

CC1(O)C(=O)N(Cc2c(F)cccc2Cl)c2cc(C(=O)O)ccc21

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STING1 Q86WV6 3/20 0.61
TP53 P04637 4/20 0.45
THRB P10828 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ATM Q13315 1/20 0.44
MAPT P10636 2/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
RXFP1 Q9HBX9 1/20 0.43
RORC P51449 1/20 0.42
EDNRB P24530 1/20 0.42
EDNRA P25101 1/20 0.42
LMNA P02545 1/20 0.41
POLB P06746 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
SCHEMBL22043972 0.91 STING1 (0.73) STING1TP53THRBMEN1KMT2A
SCHEMBL21990175 0.89 STING1 (0.61) STING1TP53THRBMEN1KMT2A
SCHEMBL21932345 0.85 STING1 (0.56) STING1TP53MEN1KMT2AATM
SCHEMBL21989993 0.85 STING1 (0.85) STING1TP53KMT2AMAPTSMN1; SMN2
SCHEMBL21905610 0.84 STING1 (0.55) STING1TP53THRBMEN1KMT2A
SCHEMBL20594824 0.84 STING1 (0.50) STING1TP53THRBMEN1KMT2A
SCHEMBL21972427 0.82 STING1 (0.52) STING1TP53KMT2AMAPTSMN1; SMN2
SCHEMBL25831968 0.80 STING1 (0.87) STING1TP53KMT2AMAPTSMN1; SMN2
SCHEMBL25809782 0.80 STING1 (0.72) STING1TP53THRBMEN1KMT2A
SCHEMBL22044779 0.79 STING1 (0.61) STING1TP53THRBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-06-04 US disclosed
US-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING CURADEV PHARMA LIMITED (GB) 2020-06-04 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-20200172483-A1 HETEROCYCLIC SMALL MOLECULE MODULATORS OF HUMAN STING STING1, IRF3, CGAS STING1 1/4885TP53 131/4885THRB 2732/4885

“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.