SCHEMBL11229520

SCHEMBL11229520

CC(Cl)Oc1ccc(OC(C)Cl)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A3 P47895 1/20 0.41
KMT2A Q03164 2/20 0.39
PARP10 Q53GL7 1/20 0.38
ALDH1A1 P00352 3/20 0.38
TSHR P16473 1/20 0.38
POLB P06746 2/20 0.36
CYP1A2 P05177 2/20 0.35
CYP2C9 P11712 2/20 0.35
CYP2C19 P33261 2/20 0.35
GAA P10253 1/20 0.35
PKM P14618 1/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL10601649 0.89 POLB (0.48) ALDH1A1POLBCYP1A2CYP2C9CYP2C19
SCHEMBL11020628 0.89 ACHE (0.46) ALDH1A3KMT2AALDH1A1TSHRPOLB
SCHEMBL2001545 0.86 CA4 (0.43) KMT2AALDH1A1TSHRPOLBCYP1A2
SCHEMBL10736121 0.83 POLB (0.40) KMT2AALDH1A1POLBCYP1A2CYP2C19
SCHEMBL27962523 0.82 LMNA (0.40) KMT2AALDH1A1CYP1A2CYP2C9CYP2C19
SCHEMBL8368010 0.82 ALDH1A3 (0.30) ALDH1A3
SCHEMBL27669789 0.82 LTA4H (0.45) ALDH1A1TSHRPOLBCYP1A2CYP2C19
SCHEMBL10572046 0.82 ALDH1A3 (0.70) ALDH1A3KMT2APARP10ALDH1A1
SCHEMBL10656787 0.80 HPGD (0.57) KMT2APARP10ALDH1A1POLBGAA
SCHEMBL13607576 0.78 ALDH1A1 (0.55) ALDH1A1TSHRCA12CA1CA2

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-4346244-A Preparation of chloroalkoxybenzenes RHONE-POULENC INDUSTRIES (FR) 1982-08-24 US claimed
US-4346244-A Preparation of chloroalkoxybenzenes RHONE-POULENC INDUSTRIES (FR) 1982-08-24 US disclosed