SCHEMBL46936

SCHEMBL46936

CSCc1cccc(C(=O)O)c1

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.59
SMN1; SMN2 Q16637 4/20 0.59
HTT P42858 1/20 0.59
MRGPRX4 Q96LA9 6/20 0.54
AR P10275 1/20 0.54
RAB9A P51151 3/20 0.52
TP53 P04637 2/20 0.50
PKM P14618 2/20 0.50
NFKB1 P19838 2/20 0.50
NFKB2 Q00653 2/20 0.50
RELA Q04206 2/20 0.50
RXFP1 Q9HBX9 2/20 0.50
EPHX1 P07099 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
HIF1A Q16665 1/20 0.49
ANPEP P15144 1/20 0.49
ENPEP Q07075 1/20 0.49

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
SCHEMBL20342670 0.85 EPHX1 (0.51) SMN1; SMN2HTTMRGPRX4RAB9AEPHX1
SCHEMBL39630 0.85 FOLH1 (0.63) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL20668077 0.84 PARP1 (0.52) FOLH1SMN1; SMN2HTTRAB9AEPHX1
SCHEMBL8570687 0.82 SMN1; SMN2 (0.42) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL39841 0.82 SMN1; SMN2 (0.56) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL9976790 0.81 FOLH1 (0.59) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL27326766 0.81 FOLH1 (0.59) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL28544976 0.81 FOLH1 (0.59) FOLH1SMN1; SMN2HTTMRGPRX4AR
SCHEMBL20130636 0.81 SLC7A5 (0.56) SMN1; SMN2MRGPRX4RAB9A
SCHEMBL6011693 0.81 LOXL2 (0.66) FOLH1SMN1; SMN2MRGPRX4RAB9AHIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230018687-A1 METHODS FOR TREATING HEMOLYTIC DISEASES AND SICKLE CELL DISEASE PURDUE RESEARCH FOUNDATION 2023-01-19 US disclosed
WO-2020167952-A1 MAT2A INHIBITORS Mirati Therapeutics, Inc. (US) 2020-08-20 WO disclosed
US-20180078552-A1 METHODS FOR TREATING HEMOLYTIC DISEASES AND SICKLE CELL DISEASE PURDUE RESEARCH FOUNDATION 2018-03-22 US disclosed
WO-2012006475-A1 COMPOUNDS AND METHODS FOR INHIBITING PHOSPHATE TRANSPORT ARDELYX, INC. (US) 2012-01-12 WO disclosed
US-20100069381-A1 GSK-3BETAINHIBITOR TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-18 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 (3 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-20180078552-A1 METHODS FOR TREATING HEMOLYTIC DISEASES AND SICKLE CELL DISEASE SYK, BTK, CD47 FOLH1 2731/4885SMN1; SMN2 666/4885HTT 276/4885
US-20100069381-A1 GSK-3BETAINHIBITOR GSK3B, GSK3A, GSKIP FOLH1 2838/4885SMN1; SMN2 1036/4885HTT 3480/4885
US-20230018687-A1 METHODS FOR TREATING HEMOLYTIC DISEASES AND SICKLE CELL DISEASE SYK, BTK, CD47 FOLH1 2731/4885SMN1; SMN2 666/4885HTT 276/4885

“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.