SCHEMBL13488495

SCHEMBL13488495

CCCCCC(=O)Oc1ccc(-c2ccc(-c3cc4c(c5ccccc35)C=CC(c3ccccc3)(c3ccc(F)cc3)O4)cc2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 6/20 0.36
ALDH1A1 P00352 1/20 0.36
HSD17B10 Q99714 1/20 0.36
POLM Q9NP87 1/20 0.34
POLK Q9UBT6 1/20 0.34
POLL Q9UGP5 1/20 0.34
POLH Q9Y253 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
RECQL P46063 1/20 0.33
RAB9A P51151 2/20 0.33
ESR1 P03372 2/20 0.33
NPC1 O15118 1/20 0.33
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
RET P07949 1/20 0.32
TRAP1 Q12931 1/20 0.32
ESR2 Q92731 1/20 0.32
DUSP3 P51452 1/20 0.32

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
SCHEMBL13488498 0.87 KMT2A (0.38) KMT2AALDH1A1SMN1; SMN2MEN1RAB9A
SCHEMBL3026766 0.83 RARB (0.36) KMT2AALDH1A1MEN1MAPT
SCHEMBL13488505 0.78 GPR84 (0.35) KMT2AALDH1A1HSD17B10SMN1; SMN2KDM4E
SCHEMBL3032436 0.76 SLC6A2 (0.36) KMT2AMEN1ESR1TP53MAPT
SCHEMBL3036691 0.73 THRA (0.37) KMT2ASMN1; SMN2TP53
SCHEMBL3701217 0.72 ACACA (0.43) KMT2AALDH1A1SMN1; SMN2KDM4EMEN1
SCHEMBL3031793 0.69 HRH3 (0.38) ALDH1A1KDM4EMAPT
SCHEMBL27567778 0.69 KMT2A (0.57) KMT2AALDH1A1HSD17B10POLMPOLK
SCHEMBL9395594 0.68 KMT2A (0.57) KMT2ASMN1; SMN2KDM4EMEN1RECQL
SCHEMBL28125267 0.68 KMT2A (0.57) KMT2ASMN1; SMN2KDM4EMEN1RECQL

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-8436184-B2 6-(biphenyl-ester)-3H-naphtho[2,1-b]pyrans as photochromic dichroic dyes and optical article containing them ESSILOR INTERNATIONAL (COMPAGNIE GENERALE D'OPTIQUE (FR) 2013-05-07 US disclosed
US-20100039688-A1 6-(BIPHENYL-ESTER)-3H-NAPHTHO[2,1-B]PYRANS AS PHOTOCHROMIC DICHROIC DYES AND OPTICAL ARTICLE CONTAINING THEM ESSILOR INTERNATIONAL (FR) 2010-02-18 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-20100039688-A1 6-(BIPHENYL-ESTER)-3H-NAPHTHO[2,1-B]PYRANS AS PHOTOCHROMIC DICHROIC DYES AND OPTICAL ARTICLE CONTAINING THEM NR0B1, CBR1, NR0B2 KMT2A 2816/4885ALDH1A1 390/4885HSD17B10 897/4885

“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.