SCHEMBL29307776

SCHEMBL29307776

CCCCCOc1cc2c3cc(OCCCCC)c(OCCCCC)cc3c3c(cc(OCCCCC)c4oc(-c5ccc(C)cc5)nc43)c2cc1OCCCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.39
▸ ALDH1A1 P00352 5/20 0.37
▸ KDM4E B2RXH2 4/20 0.37
▸ TSHR P16473 3/20 0.37
▸ HSD17B10 Q99714 3/20 0.37
▸ CYP1A2 P05177 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37
▸ CYP2C19 P33261 1/20 0.37
▸ BCHE P06276 1/20 0.36
▸ ACHE P22303 1/20 0.36
▸ ESR1 P03372 2/20 0.36
▸ ESR2 Q92731 2/20 0.36
▸ NPC1 O15118 3/20 0.35
▸ RAB9A P51151 3/20 0.35
▸ SMN1; SMN2 Q16637 2/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ TARBP2 Q15633 1/20 0.34
▸ CETP P11597 2/20 0.34
▸ TP53 P04637 1/20 0.34
▸ HPGD P15428 1/20 0.34

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
SCHEMBL29307771 0.90 BCHE (0.39) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL29307786 0.88 PTPN1 (0.37) MAPTALDH1A1KDM4EHSD17B10ESR1
SCHEMBL29307769 0.86 PTPN1 (0.41) MAPTALDH1A1TSHRHSD17B10CYP1A2
SCHEMBL29307768 0.85 PTPN1 (0.41) MAPTBCHEACHEESR1ESR2
SCHEMBL29307775 0.83 MAPT (0.36) MAPTCYP1A2CYP2C19BCHEACHE
SCHEMBL29307784 0.82 PTPN1 (0.44) MAPTALDH1A1KDM4ETSHRHSD17B10
SCHEMBL29307773 0.82 MCHR1 (0.35) MAPTALDH1A1KDM4EBCHEACHE
SCHEMBL29307767 0.81 TLR8 (0.39) MAPTCYP1A2PTPN1LMNAGAA
SCHEMBL29307788 0.81 HTT (0.37) MAPTALDH1A1KDM4EBCHEACHE
SCHEMBL29307778 0.79 KLK7 (0.45) MAPTALDH1A1KDM4EHSD17B10ESR1

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-12041850-B2 Luminescent compounds Chromatwist Limited (GB) 2024-07-16 — — 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-12041850-B2 Luminescent compounds AHR, ARNT, CYCS MAPT 4531/4885ALDH1A1 2463/4885KDM4E 2504/4885

“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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