SCHEMBL26630769

SCHEMBL26630769

CCC1(CC)c2cc(-c3ccccc3)ccc2-c2c1c1c(c3cc(OC)c(N4CCOCC4)cc23)OC(c2ccc(C)cc2)(c2ccc(N3CCOCC3)cc2)C=C1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PIK3CA P42336 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
ALDH1A1 P00352 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 1/20 0.30
HPGD P15428 1/20 0.30
RAB9A P51151 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30

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
SCHEMBL26627848 0.97 PIK3CA (0.32) PIK3CAKDM4ENPC1ALDH1A1LMNA
SCHEMBL26630602 0.96 MAPT (0.32) PIK3CAKDM4ENPC1ALDH1A1LMNA
SCHEMBL26627834 0.95 PRKDC (0.33) PIK3CAKDM4ENPC1ALDH1A1LMNA
SCHEMBL25599981 0.94 PIK3CA (0.32) PIK3CAKDM4ENPC1ALDH1A1LMNA
SCHEMBL26627795 0.94 PRKDC (0.31) KDM4EALDH1A1HPGD
SCHEMBL26627757 0.93 KDM4E (0.33) PIK3CAKDM4ENPC1ALDH1A1LMNA
SCHEMBL25599974 0.93 PRKDC (0.34) KDM4EALDH1A1LMNARAB9A
SCHEMBL25599977 0.92 PIK3CA (0.30) PIK3CA
SCHEMBL26627815 0.92 PRKDC (0.34) RAB9A
SCHEMBL26630662 0.92 STK10 (0.32) PIK3CAKDM4ENPC1ALDH1A1LMNA

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-20230340318-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES HOYA LENS THAILAND LTD. (TH) 2023-10-26 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-20230340318-A1 PHOTOCHROMIC COMPOUND, PHOTOCHROMIC COMPOSITION, PHOTOCHROMIC ARTICLE, AND EYEGLASSES NR2E3, CRY1, RPS10 PIK3CA 3076/4885KDM4E 3270/4885NPC1 2366/4885

“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.