SCHEMBL18905705

SCHEMBL18905705

Cc1ccc(N2/C(=C3\N(c4ccc(C(C)(C)C)cc4)c4ccc(C)cc4N3c3ccc(C)cc3)N(c3ccc(C(C)(C)C)cc3)c3cc(C)ccc32)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
HSD11B1 P28845 1/20 0.38
AGTR1 P30556 1/20 0.38
F2 P00734 1/20 0.37
ELANE P08246 1/20 0.37
CTSG P08311 1/20 0.37
CMA1 P23946 1/20 0.37
CTRC Q99895 1/20 0.37
NPC1 O15118 1/20 0.37
MAPT P10636 1/20 0.37
RAB9A P51151 1/20 0.37
CA9 Q16790 3/20 0.35
CA12 O43570 2/20 0.35
CA1 P00915 2/20 0.35
MGLL Q99685 1/20 0.35
BCHE P06276 1/20 0.35
ACHE P22303 1/20 0.35
NR1H4 Q96RI1 1/20 0.35
CA2 P00918 1/20 0.35
NR1I2 O75469 3/20 0.33

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
SCHEMBL20062869 0.88 TSHR (0.52) TSHRHSD11B1AGTR1F2ELANE
SCHEMBL18905733 0.88 ELANE (0.46) TSHRAGTR1F2ELANECTSG
SCHEMBL18905684 0.86 CA9 (0.39) TSHRNPC1MAPTRAB9ACA9
SCHEMBL18905679 0.86 CA9 (0.39) TSHRNPC1MAPTRAB9ACA9
SCHEMBL18905743 0.83 HSP90AA1 (0.41) TSHRMAPTMGLL
SCHEMBL18905701 0.82 TSHR (0.41) TSHRHSD11B1AGTR1NPC1MAPT
SCHEMBL18905690 0.81 KIF11 (0.40) TSHRNPC1RAB9ACA9CA12
SCHEMBL18905670 0.80 KCNH2 (0.41) TSHRHSD11B1NPC1MAPTRAB9A
SCHEMBL18905676 0.78 PMM2 (0.40) TSHRHSD11B1NPC1MAPTCA9
SCHEMBL18905748 0.78 MGLL (0.38) TSHRNPC1MAPTRAB9ACA9

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-9882148-B2 Organic compound, field element, organic light-emitting element, display apparatus, image information-processing apparatus, lighting apparatus, image-forming apparatus, and exposure apparatus CANON KABUSHIKI KAISHA (JP) 2018-01-30 US disclosed
US-20170155059-A1 ORGANIC COMPOUND, FIELD ELEMENT, ORGANIC LIGHT-EMITTING ELEMENT, DISPLAY APPARATUS, IMAGE INFORMATION-PROCESSING APPARATUS, LIGHTING APPARATUS, IMAGE-FORMING APPARATUS, AND EXPOSURE APPARATUS CANON KABUSHIKI KAISHA (JP) 2017-06-01 US disclosed
US-20170155059-A1 ORGANIC COMPOUND, FIELD ELEMENT, ORGANIC LIGHT-EMITTING ELEMENT, DISPLAY APPARATUS, IMAGE INFORMATION-PROCESSING APPARATUS, LIGHTING APPARATUS, IMAGE-FORMING APPARATUS, AND EXPOSURE APPARATUS CANON KABUSHIKI KAISHA (JP) 2017-06-01 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-20170155059-A1 ORGANIC COMPOUND, FIELD ELEMENT, ORGANIC LIGHT-EMITTING ELEMENT, DISPLAY APPARATUS, IMAGE INFORMATION-PROCESSING APPARATUS, LIGHTING APPARATUS, IMAGE-FORMING APPARATUS, AND EXPOSURE APPARATUS SCO2, OGFOD1, OXER1 TSHR 1779/4885HSD11B1 3637/4885AGTR1 1270/4885

“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.