SCHEMBL9511525

SCHEMBL9511525

O=[N+]([O-])c1cc(Cc2ccccc2)ccc1Cl

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
VCAM1 P19320 8/20 0.56
KDM1A O60341 1/20 0.53
SMN1; SMN2 Q16637 3/20 0.52
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
LMNA P02545 1/20 0.49
GAA P10253 1/20 0.49
MAPT P10636 1/20 0.49
HTT P42858 1/20 0.49
ALDH1A1 P00352 3/20 0.48
HPGD P15428 1/20 0.48
KDM4E B2RXH2 1/20 0.48
POLB P06746 1/20 0.48
MAPK1 P28482 1/20 0.47

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
SCHEMBL29936572 1.00 VCAM1 (0.56) VCAM1KDM1ASMN1; SMN2MEN1KMT2A
SCHEMBL28555521 0.87 SMN1; SMN2 (0.59) VCAM1KDM1ASMN1; SMN2MEN1KMT2A
SCHEMBL6349993 0.87 TSHR (0.53) VCAM1KDM1ASMN1; SMN2MEN1KMT2A
SCHEMBL13239653 0.85 VCAM1 (0.50) VCAM1SMN1; SMN2MEN1KMT2ALMNA
SCHEMBL27986576 0.84 HTR1A (0.50) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL8901138 0.82 VCAM1 (0.46) VCAM1KDM1ASMN1; SMN2MEN1KMT2A
SCHEMBL9524443 0.80 VCAM1 (0.48) VCAM1KDM1ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL628111 0.80 ALDH1A1 (0.45) VCAM1KDM1ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL1601110 0.80 IDH1 (0.58) SMN1; SMN2MEN1KMT2ALMNAMAPT
SCHEMBL10652958 0.80 CES2 (0.53) SMN1; SMN2MEN1KMT2ALMNAGAA

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-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2023-07-20 US disclosed
US-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2023-07-20 US disclosed
US-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2023-07-20 US disclosed
WO-2021099803-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA VESTLANDETS INNOVASJONSSELSKAP AS (NO) 2021-05-27 WO disclosed
EP-0268849-B1 Poly(aminoaromatic) compounds DOW CHEMICAL CO (US) 1993-10-20 EP disclosed
US-5079275-A Polyamino compound is an amino endcapped polyether, polyester, polycarbonate, resole, hydroxybutadiene THE DOW CHEMICAL COMPANY (US) 1992-01-07 US disclosed
US-4847416-A Capping of polyols with aromatic amines THE DOW CHEMICAL COMPANY (US) 1989-07-11 US disclosed
EP-0268849-A2 Poly(aminoaromatic) compounds THE DOW CHEMICAL COMPANY (US) 1988-06-01 EP 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-20230225991-A1 COMPOUNDS FOR USE IN THE TREATMENT OF ACUTE INTERMITTENT PORPHYRIA HMBS, POR, CYP2A13 VCAM1 4637/4885KDM1A 2675/4885SMN1; SMN2 4655/4885

“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.