SCHEMBL9899249

SCHEMBL9899249

COc1ccc(C2(c3ccc(Br)cc3)C=Cc3c4c(c5ccccc5c3O2)-c2ccc(-c3ccccc3)cc2C4(C)C)cc1

nearest known ligand 0.33

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACP1 P24666 1/20 0.33
GPR84 Q9NQS5 2/20 0.33
TP53 P04637 1/20 0.33
PDK2 Q15119 1/20 0.32
ACACA Q13085 1/20 0.32
NPC1 O15118 1/20 0.31
RAB9A P51151 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
ABL1 P00519 1/20 0.30
ABCB1 P08183 1/20 0.30
BCR P11274 1/20 0.30
MCL1 Q07820 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
SCHEMBL9926878 0.96 GPR84 (0.35) GPR84PDK2ACACANPC1RAB9A
SCHEMBL9898796 0.92 KDM4E (0.31) KDM4EHPGD
SCHEMBL16705204 0.91 ESR1 (0.36) GPR84PDK2ACACAABL1ABCB1
SCHEMBL26512580 0.91 ACACA (0.36) GPR84TP53PDK2ACACANPC1
SCHEMBL25607194 0.90 KDM4E (0.33) GPR84TP53PDK2ACACAKDM4E
SCHEMBL9899115 0.90 KDM4E (0.34) GPR84TP53PDK2ACACANPC1
SCHEMBL25844182 0.90 GPR84 (0.34) GPR84TP53ACACANPC1RAB9A
SCHEMBL25844185 0.90 GPR84 (0.34) GPR84TP53ACACANPC1RAB9A
SCHEMBL1189076 0.89 PDK2 (0.33) GPR84PDK2ACACAKDM4EHPGD
SCHEMBL1007779 0.89 PDK2 (0.33) GPR84PDK2ACACAKDM4EHPGD

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-9028728-B2 Photochromic materials that include indeno-fused naphthopyrans TRANSITIONS OPTICAL, INC. (US) 2015-05-12 US disclosed
US-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans TRANSITIONS OPTICAL INC. (US) 2012-06-14 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-20120145973-A1 Photochromic Materials That Include Indeno-Fused Naphthopyrans NQO1, INTS6, IPO4 ACP1 3173/4885GPR84 4624/4885TP53 770/4885

“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.