SCHEMBL22441316

SCHEMBL22441316

CCCCC(Cc1cccc(OC)c1)NC(=O)c1ccn(C)n1

nearest known ligand 0.53

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TP53 P04637 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MEN1 O00255 1/20 0.53
NPC1 O15118 1/20 0.53
RAB9A P51151 1/20 0.53
KMT2A Q03164 1/20 0.53
TAS1R3 Q7RTX0 1/20 0.46
TAS1R1 Q7RTX1 1/20 0.46
CTSK P43235 1/20 0.43
KDM4E B2RXH2 1/20 0.43
HSD17B10 Q99714 1/20 0.43
MME P08473 2/20 0.43
DGAT2 Q96PD7 1/20 0.43
LPAR3 Q9UBY5 1/20 0.42
EPHX2 P34913 2/20 0.41
FPR1 P21462 2/20 0.40

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
SCHEMBL22441315 1.00 TP53 (0.53) TP53SMN1; SMN2MEN1NPC1RAB9A
SCHEMBL22458087 0.85 SMN1; SMN2 (0.52) TP53SMN1; SMN2MEN1NPC1RAB9A
SCHEMBL29368182 0.82 GRM4 (0.53) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL22441388 0.82 GRM4 (0.53) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL22441390 0.82 GRM4 (0.53) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL22441276 0.80 TAS1R3 (0.46) TAS1R3TAS1R1CTSKMMELPAR3
SCHEMBL22441274 0.80 TAS1R3 (0.46) TAS1R3TAS1R1CTSKMMELPAR3
SCHEMBL29368864 0.80 TAS1R3 (0.61) SMN1; SMN2MEN1NPC1RAB9AKMT2A
SCHEMBL22441262 0.80 CTSK (0.52) MEN1KMT2ATAS1R3TAS1R1CTSK
SCHEMBL22441265 0.80 CTSK (0.52) MEN1KMT2ATAS1R3TAS1R1CTSK

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
EP-3931183-B1 COMPOUNDS WITH FERROPTOSIS INDUCING ACTIVITY AND METHODS OF THEIR USE FERRO THERAPEUTICS INC (US) 2025-02-12 EP disclosed
CN-114008024-A Compounds having iron death inducing activity and methods of using the same 费罗治疗公司 2022-02-01 CN disclosed
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 TP53 106/4885SMN1; SMN2 2416/4885MEN1 1772/4885
US-20200299283-A1 COMPOUNDS AND METHODS OF USE AIFM2, GPX4, GPX1 TP53 106/4885SMN1; SMN2 2416/4885MEN1 1772/4885
US-11040964-B2 Compounds and methods of use AIFM2, GPX4, GPX1 TP53 106/4885SMN1; SMN2 2416/4885MEN1 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.