SCHEMBL11455156

SCHEMBL11455156

Cc1cccc(C)c1NC1CCN(C)CC1

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 1/20 0.50
▸ KDM1A O60341 1/20 0.41
▸ BRD4 O60885 1/20 0.41
▸ ATAD2 Q6PL18 1/20 0.41
▸ IDH2 P48735 1/20 0.41
▸ BTK Q06187 1/20 0.40
▸ SSTR1 P30872 1/20 0.40
▸ SSTR4 P31391 1/20 0.40
▸ PIK3CD O00329 1/20 0.39
▸ JAK2 O60674 1/20 0.39
▸ JAK1 P23458 1/20 0.39
▸ JAK3 P52333 1/20 0.39
▸ HTR2A P28223 1/20 0.39
▸ HTR2C P28335 1/20 0.39
▸ EHMT2 Q96KQ7 1/20 0.39
▸ KAT2B Q92831 1/20 0.38
▸ ALOX12 P18054 1/20 0.38
▸ EPHX1 P07099 1/20 0.38

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
SCHEMBL28332795 0.84 ALOX12 (0.44) POLBALOX12EPHX1
SCHEMBL11457747 0.82 ROCK2 (0.51) JAK1
SCHEMBL26268468 0.80 POLB (0.49) POLBKDM1ABRD4BTKSSTR1
SCHEMBL22429117 0.79 ALOX12 (0.57) POLBALOX12EPHX1
SCHEMBL11239321 0.76 KDM4E (0.48) —
SCHEMBL9785716 0.76 POLB (0.59) POLB
SCHEMBL11457761 0.76 HTR2C (0.49) KDM1ABRD4ATAD2HTR2CALOX12
Bromide SCHEMBL11447604 0.74 HTR2C (0.47) KDM1ABRD4ATAD2HTR2CALOX12
SCHEMBL15829966 0.74 POLB (0.54) POLBIDH2HTR2AHTR2CALOX12
SCHEMBL11447225 0.74 NOS2 (0.63) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4225606-A ANTIARRHYTHEMIA AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1980-09-30 — — US disclosed
US-4208418-A ANTIARRHYTHMIA JANSSEN PHARMACEUTICA N.V. (BE) 1980-06-17 — — US disclosed
US-4198411-A ANTIARRHYTHMIC AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1980-04-15 — — US disclosed
US-4197303-A ANTIARRHYTHMIA AGENTS, ALKOXYCARBONYL ON 4-POSITION OF PIPERIDINE JANSSEN PHARMACEUTICA N.V. (BE) 1980-04-08 — — US disclosed
US-4197304-A ANTIARRHYTHMIA AGENTS, N-PYRIDINYL-N-(4-ALKYLPIPERIDINYL)THIENYLACETAMIDES JANSSEN PHARMACEUTICA N.V. (BE) 1980-04-08 — — US disclosed
US-4196210-A ANTIARRHYTHMIA AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1980-04-01 — — US disclosed
US-4157393-A ANTIARRHYTHMIA AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1979-06-05 — — US disclosed
US-4151286-A ANTIARRHYTHMIC AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1979-04-24 — — US disclosed
US-4126689-A ANTIARRHYTHMIA JANSSEN PHARMACEUTICA N.V. (BE) 1978-11-21 — — US disclosed
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