SCHEMBL16479409

SCHEMBL16479409

COC(=O)c1cc2cc(C(=O)Oc3ccc(-c4ccc(O)cc4)cc3)ccc2c2c1C=CC(c1ccccc1)(c1ccc(N3CCCCC3)cc1)O2

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 4/20 0.34
ESR2 Q92731 4/20 0.34
NPC1 O15118 3/20 0.34
ALDH1A1 P00352 5/20 0.33
NPSR1 Q6W5P4 3/20 0.33
TSHR P16473 2/20 0.33
MRGPRX4 Q96LA9 1/20 0.33
ALOX5 P09917 1/20 0.33
MAPT P10636 6/20 0.33
KMT2A Q03164 5/20 0.33
MEN1 O00255 4/20 0.33
CYP1A2 P05177 3/20 0.33
CYP3A4 P08684 3/20 0.33
SMN1; SMN2 Q16637 3/20 0.33
CYP2C9 P11712 2/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
KDM4E B2RXH2 2/20 0.33
RAB9A P51151 2/20 0.33
AKT1 P31749 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
SCHEMBL16474343 0.94 ALDH1A1 (0.34) ESR1ESR2NPC1ALDH1A1NPSR1
SCHEMBL13005291 0.88 ALDH1A1 (0.33) NPC1ALDH1A1NPSR1TSHRMAPT
SCHEMBL16479408 0.87 METAP1 (0.35) ESR1ESR2ALDH1A1NPSR1TSHR
SCHEMBL7784131 0.86 MAPT (0.39) NPC1ALDH1A1NPSR1TSHRMAPT
SCHEMBL13005284 0.86 ESR1 (0.34) ESR1ESR2ALDH1A1NPSR1TSHR
SCHEMBL15693690 0.85 DHODH (0.35) NPC1ALDH1A1NPSR1TSHRMAPT
SCHEMBL15693594 0.85 NR4A2 (0.34) NPC1ALDH1A1TSHRMAPTKMT2A
SCHEMBL7777302 0.83 DHODH (0.37) NPC1ALDH1A1NPSR1TSHRMAPT
SCHEMBL7971698 0.82 MAPT (0.38) NPC1ALDH1A1NPSR1TSHRMAPT
SCHEMBL1331851 0.82 MAPT (0.44) NPC1ALDH1A1TSHRMAPTKMT2A

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-9102652-B2 Dichroic-photochromic 2H-naphtho[1,2-b]pyran compounds and devices ALPHAMICRON INCORPORATED (US) 2015-08-11 US disclosed
US-20140197361-A1 DICHROIC-PHOTOCHROMIC 2H-NAPHTHO[1,2-b]PYRAN COMPOUNDS AND DEVICES ALPHAMICRON INCORPORATED (US) 2014-07-17 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-20140197361-A1 DICHROIC-PHOTOCHROMIC 2H-NAPHTHO[1,2-b]PYRAN COMPOUNDS AND DEVICES NR0B2, NR0B1, DHCR24 ESR1 2203/4885ESR2 1078/4885NPC1 2498/4885

“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.