SCHEMBL26691525

SCHEMBL26691525

COC(=O)c1cccc2c(=O)[nH]cc([N+](=O)[O-])c12

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NR4A2 P43354 4/20 0.43
▸ ALDH1A1 P00352 8/20 0.43
▸ CREBBP Q92793 1/20 0.43
▸ DNA2 P51530 1/20 0.42
▸ CASP6 P55212 1/20 0.42
▸ CTDSP1 Q9GZU7 1/20 0.42
▸ MAPT P10636 4/20 0.41
▸ KMT2A Q03164 3/20 0.41
▸ KDM4E B2RXH2 3/20 0.41
▸ MAPK1 P28482 3/20 0.41
▸ LMNA P02545 3/20 0.41
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ TSHR P16473 2/20 0.41
▸ HPGD P15428 2/20 0.41
▸ HSD17B10 Q99714 2/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ ABCC4 O15439 1/20 0.41
▸ PLIN1 O60240 1/20 0.41
▸ CACNA1F O60840 1/20 0.41
▸ GMNN O75496 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
SCHEMBL29583090 1.00 NR4A2 (0.43) NR4A2ALDH1A1CREBBPDNA2CASP6
SCHEMBL24704203 0.82 NR4A2 (0.54) NR4A2ALDH1A1CREBBPMAPTKDM4E
SCHEMBL11322471 0.78 KMT2A (0.48) ALDH1A1MAPTKMT2AKDM4EMAPK1
SCHEMBL8416055 0.75 TDP1 (0.58) ALDH1A1MAPTKMT2AKDM4EMAPK1
SCHEMBL11359085 0.75 TSHR (0.54) ALDH1A1DNA2CASP6CTDSP1MAPT
SCHEMBL30033568 0.74 ALDH1A1 (0.50) ALDH1A1DNA2CASP6CTDSP1MAPT
SCHEMBL2843773 0.72 NR4A2 (0.62) NR4A2ALDH1A1CREBBPMAPTKMT2A
SCHEMBL9080086 0.72 KMT2A (0.46) ALDH1A1MAPTKMT2AKDM4EMAPK1
SCHEMBL29959661 0.71 TSHR (0.70) ALDH1A1MAPTKMT2AKDM4EMAPK1
SCHEMBL307312 0.71 TSHR (0.70) ALDH1A1MAPTKMT2AKDM4EMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 — — US disclosed
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY C 4 Therapeutics, Inc. (US) 2024-01-18 — — US disclosed
US-20230372496-A1 TRICYCLIC HETEROBIFUNCTIONAL COMPOUNDS FOR DEGRADATION OF TARGETED PROTEINS C4 THERAPEUTICS, INC. (US) 2023-11-23 — — US disclosed
US-20230372496-A1 TRICYCLIC HETEROBIFUNCTIONAL COMPOUNDS FOR DEGRADATION OF TARGETED PROTEINS C4 THERAPEUTICS, INC. (US) 2023-11-23 — — US disclosed
CN-116723839-A Tricyclic heterobifunctional compounds for degrading target proteins C4医药公司 2023-09-08 — — CN disclosed
CN-116457339-A Tricyclic compounds degrading novel substrates for medical treatment C4医药公司 2023-07-18 — — CN 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 (2 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-20230372496-A1 TRICYCLIC HETEROBIFUNCTIONAL COMPOUNDS FOR DEGRADATION OF TARGETED PROTEINS CRBN, CDR2, MDM2 NR4A2 1299/4885ALDH1A1 4099/4885CREBBP 802/4885
US-20240018118-A1 TRICYCLIC COMPOUNDS TO DEGRADE NEOSUBSTRATES FOR MEDICAL THERAPY NFATC1, CTSS, MMP12 NR4A2 649/4885ALDH1A1 2267/4885CREBBP 2212/4885

“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.

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