SCHEMBL8429326

SCHEMBL8429326

Clc1cc(Cl)cc(-c2ccccn2)c1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCR1 P32246 3/20 0.64
CCR5 P51681 3/20 0.64
CCR8 P51685 3/20 0.64
ADORA2A P29274 1/20 0.61
ADORA1 P30542 1/20 0.61
GRM5 P41594 3/20 0.60
KDM4E B2RXH2 7/20 0.54
LMNA P02545 3/20 0.54
METAP1 P53582 2/20 0.54
CYP1A2 P05177 1/20 0.54
POLB P06746 1/20 0.54
BLM P54132 1/20 0.54
HIF1A Q16665 1/20 0.54
DOHH Q9BU89 1/20 0.54
P4HTM Q9NXG6 1/20 0.54
TP53 P04637 5/20 0.49
NPC1 O15118 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 4/20 0.49
PKM P14618 2/20 0.49

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
SCHEMBL16352566 0.96 CCR1 (0.64) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL18697686 0.90 CCR1 (0.58) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL5108411 0.88 CCR1 (0.56) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL25463227 0.87 CCR1 (0.55) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL22081696 0.87 ADORA2A (0.57) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL16672906 0.84 KDM4E (0.68) CCR1CCR5CCR8GRM5KDM4E
SCHEMBL550801 0.83 GRM5 (0.62) CCR1CCR5CCR8GRM5KDM4E
SCHEMBL29726791 0.83 GRM5 (0.62) CCR1CCR5CCR8GRM5KDM4E
SCHEMBL9958026 0.83 CCR1 (0.70) CCR1CCR5CCR8ADORA2AADORA1
SCHEMBL27911207 0.82 KDM1A (0.51) CCR1CCR5CCR8ADORA2AADORA1

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11773078-B2 Furin inhibitors GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2023-10-03 US disclosed
US-20220315556-A1 FURIN INHIBITORS GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) 2022-10-06 US disclosed
CN-109273615-B Organic light-emitting device 长春海谱润斯科技有限公司 2020-09-25 CN disclosed
CN-109273615-A A kind of organic luminescent device 长春海谱润斯科技有限公司 2019-01-25 CN disclosed
CN-109251194-A A kind of triaizine compounds and its organic luminescent device of the class formation containing fluorenes 长春海谱润斯科技有限公司 2019-01-22 CN disclosed
US-5892061-A REACTING A MONO- OR POLYCARBOXYLIC ACID WITH A MONO- OR POLYAMIDE IN THE PRESENCE OF A HALOIMINIUM SALT AND BASE; CATALYST SELECTIVITY MITSUI CHEMICALS, INC. (JP) 1999-04-06 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 (2 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-20220315556-A1 FURIN INHIBITORS FURIN, TGFB1, PCSK7 CCR1 1031/4885CCR5 1197/4885CCR8 1753/4885
US-11773078-B2 Furin inhibitors FURIN, TGFB1, PCSK7 CCR1 1031/4885CCR5 1197/4885CCR8 1753/4885

“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.