SCHEMBL290393

SCHEMBL290393

CCC(P)(CC)Oc1ccccn1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.37
▸ KDM4E B2RXH2 2/20 0.37
▸ CYP1A2 P05177 2/20 0.37
▸ LMNA P02545 1/20 0.37
▸ POLB P06746 1/20 0.37
▸ CCR1 P32246 1/20 0.37
▸ CCR5 P51681 1/20 0.37
▸ CCR8 P51685 1/20 0.37
▸ METAP1 P53582 1/20 0.37
▸ BLM P54132 1/20 0.37
▸ HIF1A Q16665 1/20 0.37
▸ DOHH Q9BU89 1/20 0.37
▸ P4HTM Q9NXG6 1/20 0.37
▸ CYP2D6 P10635 3/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ CYP2C19 P33261 2/20 0.36
▸ NPC1 O15118 1/20 0.36
▸ KCNA5 P22460 2/20 0.35
▸ KCNH2 Q12809 1/20 0.35
▸ GABRA5 P31644 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
SCHEMBL21579326 0.79 TSHR (0.41) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL15576289 0.79 KDM4E (0.41) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL26237923 0.75 KDM4E (0.41) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL31612410 0.74 KDM4E (0.44) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL2732179 0.74 KDM4E (0.44) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL5520187 0.73 TSHR (0.43) TSHRCYP1A2LMNAPOLBP4HTM
SCHEMBL3115287 0.73 CHRM2 (0.35) TSHRKDM4ECYP1A2LMNAPOLB
SCHEMBL10640000 0.71 TSHR (0.36) TSHRCYP1A2LMNACYP2D6ALDH1A1
SCHEMBL3369844 0.71 TSHR (0.48) TSHRCYP1A2LMNAPOLBP4HTM
SCHEMBL152133 0.71 — —

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-8133581-B2 Electroconductive polymer composition, electroconductive polymer material and method for producing electroconductive polymer material FUJIFILM CORPORATION (JP) 2012-03-13 — — US disclosed
US-20100136329-A1 ELECTROCONDUCTIVE POLYMER COMPOSITION, ELECTROCONDUCTIVE POLYMER MATERIAL AND METHOD FOR PRODUCING ELECTROCONDUCTIVE POLYMER MATERIAL FUJIFILM CORPORATION (JP) 2010-06-03 — — US disclosed
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