SCHEMBL21283631

SCHEMBL21283631

O=C/C(=N/Nc1ccccc1)c1ccccc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 9/20 0.45
▸ MAPT P10636 7/20 0.45
▸ GAA P10253 7/20 0.42
▸ KMT2A Q03164 6/20 0.42
▸ RAB9A P51151 6/20 0.42
▸ MEN1 O00255 4/20 0.42
▸ TDP1 Q9NUW8 2/20 0.42
▸ MAPK1 P28482 1/20 0.42
▸ SMN1; SMN2 Q16637 4/20 0.41
▸ NPC1 O15118 4/20 0.40
▸ L3MBTL1 Q9Y468 2/20 0.40
▸ HPGD P15428 1/20 0.40
▸ LMNA P02545 3/20 0.39
▸ HTT P42858 2/20 0.39
▸ NPSR1 Q6W5P4 2/20 0.39
▸ KDM4E B2RXH2 2/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ NPY1R P25929 1/20 0.39
▸ NPY2R P49146 1/20 0.39
▸ NOX1 Q9Y5S8 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
SCHEMBL3277615 1.00 ALDH1A1 (0.45) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL24157313 0.79 NFE2L2 (0.42) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL28906161 0.79 KDM4E (0.46) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL1482908 0.78 ALDH1A1 (0.48) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL2556704 0.77 MAPT (0.64) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL2556700 0.77 MAPT (0.64) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL27308313 0.77 EGFR (0.60) MAPTLMNA
SCHEMBL14294535 0.74 CA1 (0.41) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL11752824 0.74 GFER (0.46) ALDH1A1MAPTGAAKMT2ARAB9A
SCHEMBL9883332 0.74 CA1 (0.41) ALDH1A1MAPTGAAKMT2ARAB9A

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-11279677-B2 Photochromic hydrazone switches THE TRUSTEES OF DARTMOUTH COLLEGE (US) 2022-03-22 — — US disclosed
US-20190256472-A1 PHOTOCHROMIC HYDRAZONE SWITCHES DARTMOUTH COLLEGE (US) 2019-08-22 — — 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-20190256472-A1 PHOTOCHROMIC HYDRAZONE SWITCHES CRYZ, PIN1, PPOX ALDH1A1 404/4885MAPT 702/4885GAA 4201/4885
US-11279677-B2 Photochromic hydrazone switches CRYZ, PIN1, PPOX ALDH1A1 404/4885MAPT 702/4885GAA 4201/4885

“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.

Send feedback