SCHEMBL29799396

SCHEMBL29799396

CC1(Oc2ccc([N+](=O)[O-])cc2)CCN(C(=O)C(F)(F)F)CC1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ POLB P06746 1/20 0.41
▸ ENPP2 Q13822 3/20 0.41
▸ ALDH1A1 P00352 3/20 0.40
▸ LMNA P02545 2/20 0.40
▸ MAPT P10636 2/20 0.40
▸ SMN1; SMN2 Q16637 2/20 0.40
▸ GAA P10253 1/20 0.39
▸ NR1H4 Q96RI1 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ PKM P14618 1/20 0.38
▸ MGLL Q99685 1/20 0.38
▸ KCNJ1 P48048 1/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP2D6 P10635 1/20 0.38

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
SCHEMBL29799432 0.83 EPHX2 (0.40) GAA
SCHEMBL29799546 0.83 EPHX2 (0.40) GAA
SCHEMBL29799492 0.81 ESR1 (0.39) ENPP2
SCHEMBL17848404 0.81 ALDH1A1 (0.62) KMT2AMEN1ALDH1A1LMNAMAPT
SCHEMBL7383256 0.81 ALDH1A1 (0.41) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL12449358 0.79 HRH3 (0.40) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL20474622 0.78 HSPB1 (0.47) POLBALDH1A1LMNASMN1; SMN2GAA
Trifluoroacetic Acid SCHEMBL28859028 0.78 ALDH1A1 (0.43) KMT2AMEN1ALDH1A1MAPTSMN1; SMN2
SCHEMBL17848342 0.77 ALDH1A1 (0.57) KMT2AMEN1POLBALDH1A1LMNA
SCHEMBL30985057 0.77 POLB (0.51) KMT2AMEN1POLBENPP2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240327351-A1 AMIDE AND ETHER SUBSTITUTED N-(1H-INDOL-7-YL)BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES INC (US) 2024-10-03 — — US disclosed
WO-2022173805-A1 AMIDE AND ETHER SUBSTITUTED N-(1H-INDOL-7-YL)BENZENESULFONAMIDES AND USES THEREOF TRIANA BIOMEDICINES, INC. (US) 2022-08-18 — — WO 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 (1 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-20240327351-A1 AMIDE AND ETHER SUBSTITUTED N-(1H-INDOL-7-YL)BENZENESULFONAMIDES AND USES THEREOF PACSIN2, AADAC, DNPEP KMT2A 4218/4885MEN1 4795/4885POLB 4270/4885

“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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