SCHEMBL22064255

SCHEMBL22064255

O=C(CCCc1ccc(Cn2ccnc2)cc1)NCc1ccc(Cn2ccnc2)cc1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 6/20 0.68
CYP11B1 P15538 2/20 0.51
CYP11B2 P19099 2/20 0.51
TRPV1 Q8NER1 1/20 0.51
CYP19A1 P11511 3/20 0.50
LMNA P02545 2/20 0.50
CYP2A6 P11509 1/20 0.49
CYP2B6 P20813 1/20 0.49
WDR5 P61964 1/20 0.48
CYP1A2 P05177 2/20 0.48
USP2 O75604 1/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C19 P33261 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL20602561 0.82 CYP11B1 (0.61) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
Hydrochloric Acid SCHEMBL11477573 0.81 TBXAS1 (1.00) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
SCHEMBL20623015 0.80 CYP11B1 (0.58) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
SCHEMBL11477599 0.76 TBXAS1 (1.00) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
SCHEMBL10664980 0.76 CYP11B1 (0.70) TBXAS1CYP11B1CYP11B2CYP19A1CYP2A6
SCHEMBL11477428 0.76 TBXAS1 (0.67) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
SCHEMBL284240 0.76 SMN1; SMN2 (0.68) TBXAS1MEN1KMT2A
Hydrochloric Acid SCHEMBL11485144 0.75 TBXAS1 (1.00) TBXAS1CYP11B1CYP11B2CYP19A1LMNA
SCHEMBL15190312 0.75 HPGD (0.69) CYP19A1MEN1KMT2A
SCHEMBL11477508 0.74 TBXAS1 (0.64) TBXAS1CYP11B1CYP11B2CYP19A1CYP2A6

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-10927100-B2 Degradable imidazolium oligomer and polymer for antimicrobial applications AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2021-02-23 US disclosed
US-20200181122-A1 Degradable Imidazolium Oligomer and Polymer for Antimicrobial Applications AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2020-06-11 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 (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-10927100-B2 Degradable imidazolium oligomer and polymer for antimicrobial applications NOD2, CFTR, PUF60 TBXAS1 2982/4885CYP11B1 3790/4885CYP11B2 3749/4885
US-20200181122-A1 Degradable Imidazolium Oligomer and Polymer for Antimicrobial Applications NOD2, CFTR, PUF60 TBXAS1 2982/4885CYP11B1 3790/4885CYP11B2 3749/4885

“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.