SCHEMBL282290

SCHEMBL282290

Cc1[nH]c(C(=O)O)cc1O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 2/20 0.48
SMN1; SMN2 Q16637 2/20 0.48
ALOX15 P16050 1/20 0.48
NFKB1 P19838 1/20 0.48
BLM P54132 1/20 0.48
PIN1 Q13526 1/20 0.44
KDM4E B2RXH2 4/20 0.44
HPGD P15428 3/20 0.44
HSD17B10 Q99714 3/20 0.44
GAA P10253 1/20 0.44
ALDH1A1 P00352 2/20 0.43
LMNA P02545 2/20 0.43
DAO P14920 2/20 0.42
HCAR2 Q8TDS4 1/20 0.42
SMAD3 P84022 1/20 0.41
CYP2C19 P33261 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
MAPT P10636 2/20 0.39
SRD5A2 P31213 1/20 0.39
TPMT P51580 1/20 0.39

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
SCHEMBL12777647 0.84 KDM4E (0.55) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL10879188 0.77 NOTUM (0.55) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL5171235 0.76 SMN1; SMN2 (0.52) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL14857846 0.76 ALOX15 (0.52) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL508616 0.76 GRIN1 (0.47) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL8444440 0.76 NFKB1 (0.46) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL3117809 0.76 ALOX15 (0.46) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL18725471 0.74 GPR35 (0.59) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL20159038 0.72 ALOX15 (0.43) GPR35SMN1; SMN2ALOX15NFKB1BLM
SCHEMBL3282391 0.71 DAO (0.50) GPR35SMN1; SMN2ALOX15NFKB1BLM

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-8957087-B2 Heterocyclic substituted acardite derivate and application thereof Jiangsu Provincial Institute of Materia Medica Co., Ltd. (CN) 2015-02-17 US disclosed
EP-2428506-B1 HETEROCYCLIC SUBSTITUTED ACARDITE DERIVATES AND USE THEREOF NANJING LUYESIKE PHARMACEUTICAL CO LTD (CN) 2014-03-05 EP disclosed
EP-2428506-A1 HETEROCYCLIC SUBSTITUTED ACARDITE DERIVATES AND USE THEREOF Jiangsu Provincial Institute Of Materia Medica Co. (CN) 2012-03-14 EP disclosed
US-20120053192-A1 Heterocyclic Substituted Acardite Derivate and Application Thereof NANJING LUYESIKE PHARMACEUTICAL CO., LTD. (CN) 2012-03-01 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-20120053192-A1 Heterocyclic Substituted Acardite Derivate and Application Thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, IDH1, CA7 GPR35 2068/4885SMN1; SMN2 4488/4885ALOX15 3775/4885

“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.