SCHEMBL17809771

SCHEMBL17809771

CN1CCc2c(Cl)cc(-c3cnn(C)c3)cc21

nearest known ligand 0.40

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.39
▸ RET P07949 5/20 0.37
▸ AXL P30530 2/20 0.36
▸ LRRK2 Q5S007 1/20 0.36
▸ CGAS Q8N884 1/20 0.35
▸ CREBBP Q92793 1/20 0.35
▸ ERN1 O75460 2/20 0.35
▸ FGFR3 P22607 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ KAT6A Q92794 1/20 0.35
▸ TTK P33981 3/20 0.35
▸ AURKA O14965 1/20 0.35
▸ AURKB Q96GD4 1/20 0.35
▸ INCENP Q9NQS7 1/20 0.35
▸ P2RX7 Q99572 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
SCHEMBL17806214 0.83 BRD4 (0.36) BRD4RETAXLLRRK2CGAS
SCHEMBL17809538 0.82 ERN1 (0.47) BRD4LRRK2CREBBPERN1TTK
SCHEMBL17809543 0.80 LRRK2 (0.43) BRD4RETLRRK2CREBBP
SCHEMBL17809508 0.73 KDM1A (0.49) BRD4CREBBP
SCHEMBL17785849 0.72 AXL (0.41) RETAXLLRRK2CGASERN1
SCHEMBL17794670 0.70 KCNH2 (0.46) BRD4RETTTK
SCHEMBL17809509 0.70 WDR5 (0.56) BRD4LRRK2CREBBP
SCHEMBL23055771 0.69 GRM5 (0.45) BRD4CREBBPAURKAAURKBINCENP
SCHEMBL1365942 0.69 FGFR3 (0.46) AXLERN1FGFR3KDRTTK
SCHEMBL13858787 0.68 FGFR3 (0.47) RETAXLLRRK2FGFR3KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-23 — — US disclosed
US-9763922-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2017-09-19 — — US disclosed
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2016-06-09 — — 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-20170333406-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 BRD4 11/4885RET 855/4885AXL 4534/4885
US-20160158207-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF EP300, HDAC1, HDAC10 BRD4 11/4885RET 855/4885AXL 4534/4885

“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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