SCHEMBL2129381

SCHEMBL2129381

CCCC(=O)Nc1ccc(C(=O)OC)c(O)c1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.66
ALDH1A1 P00352 4/20 0.64
CYP1A2 P05177 2/20 0.54
CYP2D6 P10635 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA9 Q16790 2/20 0.53
TP53 P04637 1/20 0.53
CA7 P43166 1/20 0.53
PDK2 Q15119 1/20 0.53
PDK4 Q16654 1/20 0.53
CA14 Q9ULX7 1/20 0.53
EGFR P00533 1/20 0.51
HPGD P15428 3/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50

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
SCHEMBL2619260 0.89 ALDH1A1 (0.65) SMN1; SMN2ALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL3633228 0.87 SMN1; SMN2 (0.64) SMN1; SMN2ALDH1A1CYP1A2CA12CA1
SCHEMBL27619507 0.85 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL2128835 0.85 ALDH1A1 (0.68) SMN1; SMN2ALDH1A1CYP1A2CYP2D6CYP2C9
SCHEMBL4239469 0.84 TDP1 (0.57) SMN1; SMN2ALDH1A1TP53HPGDKMT2A
SCHEMBL19002812 0.81 MEN1 (0.60) SMN1; SMN2ALDH1A1TP53HPGDKMT2A
SCHEMBL23309774 0.80 SMN1; SMN2 (0.56) SMN1; SMN2ALDH1A1HPGDKMT2AMEN1
SCHEMBL2127575 0.80 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1CYP1A2CA12CA1
SCHEMBL613429 0.80 SMN1; SMN2 (0.76) SMN1; SMN2CYP1A2CYP2D6CYP2C9CYP2C19
SCHEMBL15763208 0.78 SMN1; SMN2 (0.64) SMN1; SMN2CYP1A2CYP2D6CYP2C9CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-29 US disclosed
US-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2024-02-29 US disclosed
CN-116472292-A Modified proteins and protein degrading agents 上海睿跃生物科技有限公司 2023-07-21 CN disclosed
US-20230057177-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI), INC. (CN) 2023-02-23 US disclosed
WO-2021239117-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS CULLGEN (SHANGHAI) , INC. (CN) 2021-12-02 WO disclosed
US-20120101157-A1 4,5-Diamino-3-Halo-2-Hydroxybenzoic Acid Derivatives and Preparations Thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-04-26 US disclosed
US-20120101157-A1 4,5-Diamino-3-Halo-2-Hydroxybenzoic Acid Derivatives and Preparations Thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-04-26 US disclosed
US-20120101157-A1 4,5-Diamino-3-Halo-2-Hydroxybenzoic Acid Derivatives and Preparations Thereof NATIONAL DEFENSE MEDICAL CENTER (TW) 2012-04-26 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-20240066136-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS DDB1, DCLRE1A, MDM2 SMN1; SMN2 2621/4885ALDH1A1 1427/4885CYP1A2 2756/4885
US-20120101157-A1 4,5-Diamino-3-Halo-2-Hydroxybenzoic Acid Derivatives and Preparations Thereof H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16, HRH3, HRH2 SMN1; SMN2 4664/4885ALDH1A1 76/4885CYP1A2 1098/4885
US-20230057177-A1 MODIFIED PROTEINS AND PROTEIN DEGRADERS DDB1, DCLRE1A, MDM2 SMN1; SMN2 2621/4885ALDH1A1 1427/4885CYP1A2 2756/4885

“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.