SCHEMBL27213640

SCHEMBL27213640

COc1ccc(CN(Cc2ccc(OC)cc2)c2nc3ccccc3c3c2nc(OC)n3Cc2ccc(CN3CCCC3)cc2)cc1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ACP1 P24666 6/20 0.47
▸ RAB9A P51151 1/20 0.45
▸ TLR7 Q9NYK1 2/20 0.44
▸ SIGMAR1 Q99720 1/20 0.44
▸ MAPT P10636 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ HTR1A P08908 1/20 0.41
▸ HTR1D P28221 1/20 0.41
▸ HTR1B P28222 1/20 0.41
▸ PTGIR P43119 1/20 0.41
▸ SSTR5 P35346 1/20 0.41
▸ LTA4H P09960 1/20 0.40
▸ BCHE P06276 1/20 0.40
▸ FABP4 P15090 1/20 0.39

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
SCHEMBL24733063 0.89 ACP1 (0.45) ACP1RAB9ATLR7SIGMAR1MAPT
SCHEMBL29809309 0.89 ACP1 (0.45) ACP1RAB9ATLR7SIGMAR1MAPT
SCHEMBL29809097 0.88 FABP4 (0.44) ACP1RAB9ATLR7SIGMAR1MAPT
SCHEMBL29977565 0.88 ACP1 (0.44) ACP1RAB9ATLR7SIGMAR1HTR1A
SCHEMBL24733118 0.88 FABP4 (0.44) ACP1RAB9ATLR7SIGMAR1MAPT
SCHEMBL29808964 0.86 ACP1 (0.45) ACP1TLR7SIGMAR1MAPTSSTR5
SCHEMBL24733512 0.86 ACP1 (0.45) ACP1TLR7SIGMAR1MAPTSSTR5
SCHEMBL27213644 0.86 TLR7 (0.47) ACP1RAB9ATLR7SIGMAR1HTR1A
SCHEMBL28802673 0.86 TLR7 (0.47) ACP1TLR7SIGMAR1MAPTBCHE
SCHEMBL24732883 0.85 TLR7 (0.46) ACP1TLR7BCHE

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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF INNOVSTONE THERAPEUTICS LIMITED (CN) 2024-05-09 — — US disclosed
WO-2022161420-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF 上海翊石医药科技有限公司 2022-08-04 — — WO 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-20240150346-A1 CLASS OF HETEROAROMATIC COMPOUND, PREPARATION METHOD THEREFOR AND USE THEREOF TLR7, TLR1, TLR8 ACP1 3773/4885RAB9A 2034/4885TLR7 1/4885

“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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