SCHEMBL23099984

SCHEMBL23099984

C/C=C\C(=C/C)N(c1ccc2ccccc2c1)c1ccc2ccccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ ATM Q13315 1/20 0.40
▸ ESR1 P03372 1/20 0.37
▸ ESR2 Q92731 1/20 0.37
▸ ALDH1A1 P00352 4/20 0.37
▸ SMN1; SMN2 Q16637 1/20 0.37
▸ INSR P06213 1/20 0.36
▸ IGF1R P08069 1/20 0.36
▸ NR1H4 Q96RI1 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.36
▸ CYP3A4 P08684 1/20 0.35
▸ HSD17B10 Q99714 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ TP53 P04637 1/20 0.35
▸ CYP2A6 P11509 1/20 0.35
▸ TDP1 Q9NUW8 1/20 0.35
▸ CYP1A2 P05177 1/20 0.35

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
SCHEMBL19867987 0.86 ALDH1A1 (0.36) MEN1KMT2AATMESR1ESR2
SCHEMBL22166733 0.86 MEN1 (0.36) MEN1KMT2AATMESR1ESR2
SCHEMBL24106729 0.81 ALDH1A1 (0.38) MEN1KMT2AATMESR1ESR2
SCHEMBL21653369 0.77 NPSR1 (0.43) MEN1KMT2AATMALDH1A1HTT
SCHEMBL16657912 0.77 ALDH1A1 (0.33) ALDH1A1LMNATP53
SCHEMBL22593575 0.76 SIGMAR1 (0.39) MEN1KMT2AATMNR1H4CYP1A2
SCHEMBL13709429 0.76 ALDH1A1 (0.36) MEN1KMT2AESR1ESR2ALDH1A1
SCHEMBL19311818 0.76 ALDH1A1 (0.36) MEN1KMT2AESR1ESR2ALDH1A1
SCHEMBL20859796 0.75 NR1H4 (0.36) MEN1KMT2AESR1ESR2ALDH1A1
SCHEMBL13446987 0.75 CYP1B1 (0.40) ESR1NR1H4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210078934-A1 CHARGE-TRANSPORTING VARNISH NISSAN CHEMICAL CORPORATION (JP) 2021-03-18 — — 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 (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-20210078934-A1 CHARGE-TRANSPORTING VARNISH SLC43A1, SLC7A5, SLC38A7 MEN1 2373/4885KMT2A 1078/4885ATM 4199/4885

“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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