SCHEMBL9876653

SCHEMBL9876653

CCCCCC1(CN)CCC1

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 8/20 0.35
TSHR P16473 3/20 0.35
ALDH1A1 P00352 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
EPHX1 P07099 1/20 0.35
USP2 O75604 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
BLM P54132 1/20 0.33
CACNA2D1 P54289 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SIRT2 Q8IXJ6 1/20 0.31
THRB P10828 1/20 0.30

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
SCHEMBL9210728 0.98 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9211328 0.93 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9213235 0.93 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL9210517 0.93 DNM1 (0.39) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL16985055 0.93 ALDH1A1 (0.34) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL20374717 0.91 DNM1 (0.38) DNM1TSHRALDH1A1MEN1KMT2A
SCHEMBL16985042 0.86 USP2 (0.42) TSHRALDH1A1USP2LMNACYP1A2
SCHEMBL7077181 0.86 USP2 (0.42) TSHRALDH1A1USP2LMNACYP1A2
SCHEMBL11786898 0.85 TSHR (0.37) DNM1TSHRLMNASMN1; SMN2SIRT2
SCHEMBL25393764 0.83 TSHR (0.42) DNM1TSHRALDH1A1MEN1KMT2A

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-5047432-A Antidepressants THE BOOTS COMPANY PLC (GB) 1991-09-10 US disclosed
US-4925879-A ANTIDEPRESSANTS BOOTS COMPANY, PLC (GB) 1990-05-15 US disclosed