SCHEMBL9814876

SCHEMBL9814876

Cc1ccc(C(N(C)C)N(C)C)cc1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.64
ACHE P22303 5/20 0.44
TDP1 Q9NUW8 1/20 0.44
ALDH1A1 P00352 2/20 0.43
TSHR P16473 1/20 0.43
ALOX5 P09917 1/20 0.38
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35
CYP19A1 P11511 1/20 0.34
AGER Q15109 1/20 0.34
MEN1 O00255 1/20 0.33
GAA P10253 1/20 0.33
KMT2A Q03164 1/20 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
SCHEMBL12313 0.76 CHRNA7 (0.61) CHRNA7ACHETDP1ALDH1A1TSHR
SCHEMBL301685 0.76 ESR1 (0.52) ACHETDP1ALDH1A1TSHRCA1
SCHEMBL7028499 0.76 PYCR1 (0.47) CHRNA7ALDH1A1ALOX5
SCHEMBL7035638 0.76 ADRB2 (0.48) CHRNA7TDP1TSHRCYP19A1
SCHEMBL516024 0.74 HTR2A (0.50) TDP1ALDH1A1TSHRMEN1KMT2A
SCHEMBL12140855 0.74 CHRNA7 (0.58) CHRNA7ACHETDP1ALDH1A1TSHR
SCHEMBL11884088 0.72 CHRNA7 (0.44) CHRNA7ACHETDP1ALDH1A1TSHR
P-Xylene SCHEMBL19307687 0.71 ACHE (0.73) CHRNA7ACHETDP1ALDH1A1TSHR
P-Xylene SCHEMBL28253961 0.71 ACHE (0.73) CHRNA7ACHETDP1ALDH1A1TSHR
SCHEMBL10821358 0.71 CHRNA7 (0.55) CHRNA7ACHETDP1ALDH1A1TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0143582-B1 BIPOLAR MEMBRANES Chinese Petroleum Corporation (TW) 1991-09-04 EP disclosed
US-4673454-A Process for preparing bipolar membranes CHINESE PETROLEUM CORP. (TW) 1987-06-16 US disclosed
US-4584246-A Bipolar membranes CHINESE PETROLEUM CORP. (TW) 1986-04-22 US disclosed
EP-0143582-A2 Bipolar membranes Chinese Petroleum Corporation (TW) 1985-06-05 EP disclosed
US-4116889-A Bipolar membranes and method of making same ALLIED CHEMICAL CORPORATION (US) 1978-09-26 US disclosed