SCHEMBL22441253

SCHEMBL22441253

CCCCC(Cc1cccc(OC)c1)NC(=O)c1ccc(NC(=O)O)cc1

nearest known ligand 0.52

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TAS1R3 Q7RTX0 2/20 0.52
TAS1R1 Q7RTX1 2/20 0.52
MEN1 O00255 5/20 0.47
KMT2A Q03164 5/20 0.47
HIF1A Q16665 1/20 0.47
MAPT P10636 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MTNR1B P49286 3/20 0.46
MTNR1A P48039 2/20 0.46
ALDH1A1 P00352 1/20 0.45
GAA P10253 1/20 0.45
FPR1 P21462 2/20 0.44
CTSK P43235 1/20 0.44
PPARA Q07869 1/20 0.44
NAMPT P43490 1/20 0.43
PGR P06401 1/20 0.43

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
SCHEMBL22441250 1.00 TAS1R3 (0.52) TAS1R3TAS1R1MEN1KMT2AHIF1A
SCHEMBL29368864 0.90 TAS1R3 (0.61) TAS1R3TAS1R1MEN1KMT2ANPC1
SCHEMBL29368169 0.88 TAS1R3 (0.47) TAS1R3TAS1R1MEN1KMT2AMAPT
SCHEMBL28678227 0.88 TAS1R3 (0.47) TAS1R3TAS1R1MEN1KMT2AMAPT
SCHEMBL31382710 0.88 TAS1R3 (0.47) TAS1R3TAS1R1MEN1KMT2AMAPT
SCHEMBL22441335 0.87 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ASMN1; SMN2
SCHEMBL22441334 0.87 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ASMN1; SMN2
SCHEMBL29368573 0.87 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ASMN1; SMN2
SCHEMBL27175282 0.87 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ACTSK
SCHEMBL27175279 0.87 TAS1R3 (0.55) TAS1R3TAS1R1MEN1KMT2ACTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220002280-A1 COMPOUNDS AND METHODS OF USE FERRO THERAPEUTICS INC (US) 2022-01-06 US disclosed
US-11040964-B2 Compounds and methods of use Ferro Therapeutics, Inc. (US) 2021-06-22 US disclosed
US-20200299283-A1 COMPOUNDS AND METHODS OF USE BRIDGEBIO PHARMA, INC. 2020-09-24 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-20220002280-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 TAS1R3 3730/4885TAS1R1 3650/4885MEN1 1772/4885
US-20200299283-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 TAS1R3 3730/4885TAS1R1 3650/4885MEN1 1772/4885
US-11040964-B2 Compounds and methods of use AIFM2, GPX4, GPX1 TAS1R3 3730/4885TAS1R1 3650/4885MEN1 1772/4885

“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.