SCHEMBL5370150

SCHEMBL5370150

C(=Cc1ccc(Nc2ccc3ccccc3c2)cc1)c1ccc(Nc2ccc3ccccc3c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.70
CYP3A4 P08684 2/20 0.70
HSD17B10 Q99714 2/20 0.70
HPGD P15428 1/20 0.70
RELA Q04206 1/20 0.59
MAPT P10636 3/20 0.54
MEN1 O00255 1/20 0.54
LMNA P02545 1/20 0.54
GAA P10253 1/20 0.54
THRB P10828 1/20 0.54
ALOX12 P18054 1/20 0.54
MAPK1 P28482 1/20 0.54
KMT2A Q03164 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.54
KDM4E B2RXH2 1/20 0.51
GLA P06280 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
CYP1A2 P05177 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 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
SCHEMBL13304762 0.91 RELA (0.75) ALDH1A1CYP3A4HSD17B10HPGDRELA
SCHEMBL13304747 0.91 RELA (0.75) ALDH1A1CYP3A4HSD17B10HPGDRELA
SCHEMBL15138718 0.89 ALDH1A1 (0.61) ALDH1A1CYP3A4HSD17B10HPGDRELA
SCHEMBL29352988 0.87 ALDH1A1 (0.91) ALDH1A1CYP3A4HSD17B10HPGDMAPT
SCHEMBL9513153 0.87 ALDH1A1 (0.91) ALDH1A1CYP3A4HSD17B10HPGDMAPT
SCHEMBL39488 0.87 ALDH1A1 (0.91) ALDH1A1CYP3A4HSD17B10HPGDMAPT
SCHEMBL14367048 0.87 ALDH1A1 (0.54) ALDH1A1CYP3A4HSD17B10HPGDRELA
SCHEMBL12667361 0.87 ALDH1A1 (0.54) ALDH1A1CYP3A4HSD17B10HPGDRELA
SCHEMBL29673631 0.85 ALDH1A1 (0.86) ALDH1A1CYP3A4HSD17B10HPGDMAPT
Charcoal, Activated SCHEMBL29831131 0.85 ALDH1A1 (0.86) ALDH1A1CYP3A4HSD17B10HPGDMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070249866-A1 METHOD FOR PRODUCING AROMATIC AMINO COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2007-10-25 US disclosed
US-20070249861-A1 METHOD FOR PRODUCING AROMATIC AMINO COMPOUND IDEMITSU KOSAN CO., LTD. (JP) 2007-10-25 US disclosed
US-7250532-B2 Method for producing aromatic amino compound IDEMITSU KOSAN CO., LTD. (JP) 2007-07-31 US disclosed
US-20060030736-A1 Method for producing aromatic amino compound IDEMITSU KOSAN CO., LTD. (JP) 2006-02-09 US disclosed
US-20040082813-A1 Method for producting aromatic amino compound IDEMITSU KOSAN CO., LTD. (JP) 2004-04-29 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 (4 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-20070249861-A1 METHOD FOR PRODUCING AROMATIC AMINO COMPOUND SLC7A1, SLC43A1, AHR ALDH1A1 455/4885CYP3A4 246/4885HSD17B10 2282/4885
US-20060030736-A1 Method for producing aromatic amino compound SLC7A1, SLC43A1, AHR ALDH1A1 447/4885CYP3A4 214/4885HSD17B10 2243/4885
US-20040082813-A1 Method for producting aromatic amino compound ADRM1, SLC7A1, AHR ALDH1A1 594/4885CYP3A4 269/4885HSD17B10 2382/4885
US-20070249866-A1 METHOD FOR PRODUCING AROMATIC AMINO COMPOUND SLC7A1, SLC43A1, AHR ALDH1A1 455/4885CYP3A4 246/4885HSD17B10 2282/4885

“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.